4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]benzoic acid

Systemtic Name: 4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]benzoic acid Openeye Name: 4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]benzoic acid CAS Name: 4-[(E)-amino(phenylmethoxycarbonylimino)methyl]benzoic acid IUPAC Name: 4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]benzoic acid Traditional Name: 4-[(E)-N'-carbobenzoxyamidino]benzoic acid Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N=C(C2=CC=C(C=C2)C(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O4/c17-14(12-6-8-13(9-7-12)15(19)20)18-16(21)22-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,19,20)(H2,17,18,21)