2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]phenyl]benzoic acid Openeye Name: 2-[4-[(1-benzyl-2-methoxy-2-oxo-ethyl)carbamoyl]-2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-[[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-[(1-benzyl-2-keto-2-methoxy-ethyl)carbamoyl]phenyl]benzoic acid Formula: C32H28N4O6 MolecularWeight: 564.58792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C32H28N4O6/c1-42-32(41)27(17-19-7-3-2-4-8-19)36-29(37)21-13-16-24(23-9-5-6-10-25(23)31(39)40)26(18-21)30(38)35-22-14-11-20(12-15-22)28(33)34/h2-16,18,27H,17H2,1H3,(H3,33,34)(H,35,38)(H,36,37)(H,39,40)