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

Systemtic Name: methyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-ethenyl-phenyl]-5-(2-methylpropylcarbamoyl)benzoate Openeye Name: methyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-vinyl-phenyl]-5-(isobutylcarbamoyl)benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-5-ethenylphenyl]-5-[(2-methylpropylamino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-ethenylphenyl]-5-(2-methylpropylcarbamoyl)benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-5-vinyl-phenyl]-5-(isobutylcarbamoyl)benzoic acid methyl ester Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)C=C)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OC

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)C=C)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OC

InChI

InChI=1S/C29H30N4O4/c1-5-18-6-12-23(28(35)33-21-10-7-19(8-11-21)26(30)31)24(14-18)22-13-9-20(15-25(22)29(36)37-4)27(34)32-16-17(2)3/h5-15,17H,1,16H2,2-4H3,(H3,30,31)(H,32,34)(H,33,35)