CHEBI:109637 - 3-[[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester
ChEBI ID CHEBI:109637
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H23ClN4O3
Net Charge 0
Average Mass 426.897
Monoisotopic Mass 426.14587
InChI InChI=1S/C22H23ClN4O3/c1-30-22(29)21-20(17-7-2-3-8-18(17)24-21)25-19(28)14-26-9-11-27(12-10-26)16-6-4-5-15(23)13-16/h2-8,13,24H,9-12,14H2,1H3,(H,25,28)
InChIKey YJLAGRNZXPNFEG-UHFFFAOYSA-N
SMILES COC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CN3CCN(CC3)C4=CC(=CC=C4)Cl
ChEBI Ontology
Outgoing 3-[[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester (CHEBI:109637) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-21065 LINCS
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