2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethyl-3-oxidanyl-propyl)carbamoyl]benzoate

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethyl-3-oxidanyl-propyl)carbamoyl]benzoate Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(3-hydroxy-2,2-dimethyl-propyl)carbamoyl]benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[[(3-hydroxy-2,2-dimethylpropyl)amino]-oxomethyl]benzoate IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(3-hydroxy-2,2-dimethylpropyl)carbamoyl]benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-[(3-hydroxy-2,2-dimethyl-propyl)carbamoyl]benzoate Formula: C27H27N4O5- MolecularWeight: 487.52708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O5/c1-27(2,15-32)14-30-24(33)17-9-12-20(22(13-17)26(35)36)19-5-3-4-6-21(19)25(34)31-18-10-7-16(8-11-18)23(28)29/h3-13,32H,14-15H2,1-2H3,(H3,28,29)(H,30,33)(H,31,34)(H,35,36)/p-1