2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethylcyclohexyl)carbamoyl]benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethylcyclohexyl)carbamoyl]benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethylcyclohexyl)carbamoyl]benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[[(2,2-dimethylcyclohexyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(2,2-dimethylcyclohexyl)carbamoyl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-[(2,2-dimethylcyclohexyl)carbamoyl]benzoic acid Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)O)C

Isomeric SMILES

CC1(CCCCC1NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)O)C

InChI

InChI=1S/C30H32N4O4/c1-30(2)16-6-5-9-25(30)34-27(35)19-12-15-22(24(17-19)29(37)38)21-7-3-4-8-23(21)28(36)33-20-13-10-18(11-14-20)26(31)32/h3-4,7-8,10-15,17,25H,5-6,9,16H2,1-2H3,(H3,31,32)(H,33,36)(H,34,35)(H,37,38)