[2-[bis(azanyl)methylideneamino]phenyl] 2-(2-aminocarbonylhydrazinyl)-3-phenyl-propanoate

Systemtic Name: [2-[bis(azanyl)methylideneamino]phenyl] 2-(2-aminocarbonylhydrazinyl)-3-phenyl-propanoate Openeye Name: (2-guanidinophenyl) 2-(2-carbamoylhydrazino)-3-phenyl-propanoate CAS Name: 2-(carbamoylhydrazo)-3-phenylpropanoic acid [2-(diaminomethylideneamino)phenyl] ester IUPAC Name: [2-(diaminomethylideneamino)phenyl] 2-(2-carbamoylhydrazinyl)-3-phenylpropanoate Traditional Name: 3-phenyl-2-semicarbazido-propionic acid (2-guanidinophenyl) ester Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OC2=CC=CC=C2N=C(N)N)NNC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OC2=CC=CC=C2N=C(N)N)NNC(=O)N

InChI

InChI=1S/C17H20N6O3/c18-16(19)21-12-8-4-5-9-14(12)26-15(24)13(22-23-17(20)25)10-11-6-2-1-3-7-11/h1-9,13,22H,10H2,(H4,18,19,21)(H3,20,23,25)