[3-[(Z)-N-methoxy-C-methyl-carbonimidoyl]phenyl] 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: [3-[(Z)-N-methoxy-C-methyl-carbonimidoyl]phenyl] 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [3-[(Z)-N-methoxy-C-methyl-carbonimidoyl]phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [3-[(1Z)-1-methoxyiminoethyl]phenyl] ester IUPAC Name: [3-[(Z)-N-methoxy-C-methylcarbonimidoyl]phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [3-[(Z)-N-methoxy-C-methyl-carbonimidoyl]phenyl] ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC)C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

C/C(=N/OC)/C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C17H18N4O3/c1-11(21-23-2)13-4-3-5-15(10-13)24-16(22)12-6-8-14(9-7-12)20-17(18)19/h3-10H,1-2H3,(H4,18,19,20)/b21-11-