3-[[5-(cyclopentylcarbonylamino)-1-(diphenylmethyl)indol-3-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[5-(cyclopentylcarbonylamino)-1-(diphenylmethyl)indol-3-yl]carbonylamino]benzoic acid Openeye Name: 3-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]benzoic acid CAS Name: 3-[[[5-[[cyclopentyl(oxo)methyl]amino]-1-(diphenylmethyl)-3-indolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]benzoic acid Traditional Name: 3-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]benzoic acid Formula: C35H31N3O4 MolecularWeight: 557.63834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CC3=C(C=C2)N(C=C3C(=O)NC4=CC=CC(=C4)C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CC3=C(C=C2)N(C=C3C(=O)NC4=CC=CC(=C4)C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H31N3O4/c39-33(25-14-7-8-15-25)36-28-18-19-31-29(21-28)30(34(40)37-27-17-9-16-26(20-27)35(41)42)22-38(31)32(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-13,16-22,25,32H,7-8,14-15H2,(H,36,39)(H,37,40)(H,41,42)