[2-[(3-carbamimidoylphenyl)carbonylamino]-2-phenyl-ethyl] benzoate

Systemtic Name: [2-[(3-carbamimidoylphenyl)carbonylamino]-2-phenyl-ethyl] benzoate Openeye Name: [2-[(3-carbamimidoylbenzoyl)amino]-2-phenyl-ethyl] benzoate CAS Name: benzoic acid [2-[[(3-carbamimidoylphenyl)-oxomethyl]amino]-2-phenylethyl] ester IUPAC Name: [2-[(3-carbamimidoylbenzoyl)amino]-2-phenylethyl] benzoate Traditional Name: benzoic acid [2-[(3-amidinobenzoyl)amino]-2-phenyl-ethyl] ester Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)C(COC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C23H21N3O3/c24-21(25)18-12-7-13-19(14-18)22(27)26-20(16-8-3-1-4-9-16)15-29-23(28)17-10-5-2-6-11-17/h1-14,20H,15H2,(H3,24,25)(H,26,27)