(phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]naphthalene-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]naphthalene-1-carboxylate Openeye Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]naphthalene-1-carboxylate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-1-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]naphthalene-1-carboxylate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]naphthalene-1-carboxylic acid benzyl ester Formula: C32H25N3O3 MolecularWeight: 499.5592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C(C=CC3=CC=CC=C32)C4=CC=CC=C4C(=O)NC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C(C=CC3=CC=CC=C32)C4=CC=CC=C4C(=O)NC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C32H25N3O3/c33-30(34)23-14-17-24(18-15-23)35-31(36)28-13-7-6-12-26(28)27-19-16-22-10-4-5-11-25(22)29(27)32(37)38-20-21-8-2-1-3-9-21/h1-19H,20H2,(H3,33,34)(H,35,36)