[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] 2-azanylbenzoate

Systemtic Name: [4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] 2-azanylbenzoate Openeye Name: [4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenyl] 2-aminobenzoate CAS Name: 2-aminobenzoic acid [4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenyl] ester IUPAC Name: [4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] 2-aminobenzoate Traditional Name: 2-aminobenzoic acid [4-[(E)-N'-carbobenzoxyamidino]phenyl] ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N=C(C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/N=C(\C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3N)/N

InChI

InChI=1S/C22H19N3O4/c23-19-9-5-4-8-18(19)21(26)29-17-12-10-16(11-13-17)20(24)25-22(27)28-14-15-6-2-1-3-7-15/h1-13H,14,23H2,(H2,24,25,27)