methyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-methyl-4-phenylmethoxy-phenyl]-5-ethanoyl-benzoate

Systemtic Name: methyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-methyl-4-phenylmethoxy-phenyl]-5-ethanoyl-benzoate Openeye Name: methyl 5-acetyl-2-[4-benzyloxy-2-[(4-carbamimidoylphenyl)carbamoyl]-5-methyl-phenyl]benzoate CAS Name: 5-acetyl-2-[2-[(4-carbamimidoylanilino)-oxomethyl]-5-methyl-4-phenylmethoxyphenyl]benzoic acid methyl ester IUPAC Name: methyl 5-acetyl-2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-methyl-4-phenylmethoxyphenyl]benzoate Traditional Name: 5-acetyl-2-[2-[(4-amidinophenyl)carbamoyl]-4-benzoxy-5-methyl-phenyl]benzoic acid methyl ester Formula: C32H29N3O5 MolecularWeight: 535.58976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)C(=O)C)C(=O)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=C(C=C(C=C2)C(=O)C)C(=O)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

InChI

InChI=1S/C32H29N3O5/c1-19-15-26(25-14-11-23(20(2)36)16-28(25)32(38)39-3)27(17-29(19)40-18-21-7-5-4-6-8-21)31(37)35-24-12-9-22(10-13-24)30(33)34/h4-17H,18H2,1-3H3,(H3,33,34)(H,35,37)