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

Systemtic Name: [3-[(Z)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl] 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [3-[(Z)-N-hydroxy-C-methyl-carbonimidoyl]phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [3-[(1Z)-1-hydroxyiminoethyl]phenyl] ester IUPAC Name: [3-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid (3-acetohydroximoylphenyl) ester Formula: C16H16N4O3 MolecularWeight: 312.32324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O3/c1-10(20-22)12-3-2-4-14(9-12)23-15(21)11-5-7-13(8-6-11)19-16(17)18/h2-9,22H,1H3,(H4,17,18,19)/b20-10-