(phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methyl-phenyl]-5-(2-methylpropylcarbamoyl)benzoate

Systemtic Name: (phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methyl-phenyl]-5-(2-methylpropylcarbamoyl)benzoate Openeye Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methyl-phenyl]-5-(isobutylcarbamoyl)benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-methylphenyl]-5-[(2-methylpropylamino)-oxomethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methylphenyl]-5-(2-methylpropylcarbamoyl)benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-methyl-phenyl]-5-(isobutylcarbamoyl)benzoic acid benzyl ester Formula: C34H34N4O4 MolecularWeight: 562.65816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC(C)C)C(=O)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC(C)C)C(=O)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C34H34N4O4/c1-21(2)19-37-32(39)25-12-16-28(30(18-25)34(41)42-20-23-7-5-4-6-8-23)27-15-9-22(3)17-29(27)33(40)38-26-13-10-24(11-14-26)31(35)36/h4-18,21H,19-20H2,1-3H3,(H3,35,36)(H,37,39)(H,38,40)