[2-[(2-azanyl-1H-pyridin-2-yl)carbamoyl]phenyl] 2-[bis(azanyl)methylideneamino]ethanoate

Systemtic Name: [2-[(2-azanyl-1H-pyridin-2-yl)carbamoyl]phenyl] 2-[bis(azanyl)methylideneamino]ethanoate Openeye Name: [2-[(2-amino-1H-pyridin-2-yl)carbamoyl]phenyl] 2-guanidinoacetate CAS Name: 2-(diaminomethylideneamino)acetic acid [2-[[(2-amino-1H-pyridin-2-yl)amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[(2-amino-1H-pyridin-2-yl)carbamoyl]phenyl] 2-(diaminomethylideneamino)acetate Traditional Name: 2-guanidinoacetic acid [2-[(2-amino-1H-pyridin-2-yl)carbamoyl]phenyl] ester Formula: C15H18N6O3 MolecularWeight: 330.34182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2(C=CC=CN2)N)OC(=O)CN=C(N)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2(C=CC=CN2)N)OC(=O)CN=C(N)N

InChI

InChI=1S/C15H18N6O3/c16-14(17)19-9-12(22)24-11-6-2-1-5-10(11)13(23)21-15(18)7-3-4-8-20-15/h1-8,20H,9,18H2,(H,21,23)(H4,16,17,19)