{[3-(Benzylamino)-2-cyano-3-oxo-1-propenyl]amino}acetic acid

2-[[(E)-3-(benzylamino)-2-cyano-3-oxoprop-1-enyl]amino]acetic acid

Also Known As: CBMicro_014259|BIM-0014127.P001|{[3-(benzylamino)-2-cyano-3-oxo-1-propenyl]amino}acetic acid|AH-262/36336009|SR-01000199155-1|2-[[(E)-3-(benzylamino)-2-cyano-3-oxoprop-1-enyl]amino]acetic acid|N-[3-(Benzylamino)-2-cyano-3-oxo-1-propen-1-yl]glycine|2-({(1E)-2-cyano-2-[N-benzylcarbamoyl]vinyl}amino)acetic acid|N-[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]glycine

Molecular Formula	C13H13N3O3
Molecular Weight	259.0957 g/mol
LogP	0.38448
Topological Polar Surface Area	102.22 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	259.0957
Monoisotopic Mass	259.0957
Heavy Atoms	19
Complexity	517.685

Chemical Identifiers

CAS Number	5219-72-7
SMILES	C1=CC=C(C=C1)CNC(=O)/C(=C/NCC(=O)O)/C#N