2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(3,3-dimethylbutan-2-ylcarbamoyl)benzoate

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(3,3-dimethylbutan-2-ylcarbamoyl)benzoate Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(1,2,2-trimethylpropylcarbamoyl)benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[(3,3-dimethylbutan-2-ylamino)-oxomethyl]benzoate IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(3,3-dimethylbutan-2-ylcarbamoyl)benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-(1,2,2-trimethylpropylcarbamoyl)benzoate Formula: C28H29N4O4- MolecularWeight: 485.55426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)[O-]

Isomeric SMILES

CC(C(C)(C)C)NC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)[O-]

InChI

InChI=1S/C28H30N4O4/c1-16(28(2,3)4)31-25(33)18-11-14-21(23(15-18)27(35)36)20-7-5-6-8-22(20)26(34)32-19-12-9-17(10-13-19)24(29)30/h5-16H,1-4H3,(H3,29,30)(H,31,33)(H,32,34)(H,35,36)/p-1