4-[[5-(cyclopentyloxycarbonylamino)-1-(3-pyridin-2-ylpropyl)indol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[5-(cyclopentyloxycarbonylamino)-1-(3-pyridin-2-ylpropyl)indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[5-(cyclopentoxycarbonylamino)-1-[3-(2-pyridyl)propyl]indol-3-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[5-[[cyclopentyloxy(oxo)methyl]amino]-1-[3-(2-pyridinyl)propyl]-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[5-(cyclopentyloxycarbonylamino)-1-(3-pyridin-2-ylpropyl)indol-3-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[5-(cyclopentoxycarbonylamino)-1-[3-(2-pyridyl)propyl]indol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C31H33N3O5 MolecularWeight: 527.61082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CC2=CN(C3=C2C=C(C=C3)NC(=O)OC4CCCC4)CCCC5=CC=CC=N5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CC2=CN(C3=C2C=C(C=C3)NC(=O)OC4CCCC4)CCCC5=CC=CC=N5

InChI

InChI=1S/C31H33N3O5/c1-38-29-18-22(30(35)36)12-11-21(29)17-23-20-34(16-6-8-24-7-4-5-15-32-24)28-14-13-25(19-27(23)28)33-31(37)39-26-9-2-3-10-26/h4-5,7,11-15,18-20,26H,2-3,6,8-10,16-17H2,1H3,(H,33,37)(H,35,36)