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Molecule : CIR

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1
2	InChIKey	InChI	1.03	RHGKLRLOHDJJDR-BYPYZUCNSA-N
3	SMILES	ACDLabs	12.01	O=C(O)C(N)CCCNC(=O)N
4	SMILES	CACTVS	3.370	N[CH](CCCNC(N)=O)C(O)=O
5	SMILES	OpenEye OEToolkits	1.7.0	C(CC(C(=O)O)N)CNC(=O)N
6	Canonical SMILES	CACTVS	3.370	N[C@@H](CCCNC(N)=O)C(O)=O
7	Canonical SMILES	OpenEye OEToolkits	1.7.0	C(C[C@@H](C(=O)O)N)CNC(=O)N