3-cyclohexyl-1-[2-oxidanylidene-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-pyridin-4-yl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-oxidanylidene-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-pyridin-4-yl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-oxo-2-(4-pyrrolidin-1-yl-1-piperidyl)ethyl]-2-(4-pyridyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-oxo-2-[4-(1-pyrrolidinyl)-1-piperidinyl]ethyl]-2-pyridin-4-yl-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-oxo-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-pyridin-4-ylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-keto-2-(4-pyrrolidinopiperidino)ethyl]-2-(4-pyridyl)indole-6-carboxylic acid Formula: C31H38N4O3 MolecularWeight: 514.65842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCC(CC4)N5CCCC5)C6=CC=NC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCC(CC4)N5CCCC5)C6=CC=NC=C6

InChI

InChI=1S/C31H38N4O3/c36-28(34-18-12-25(13-19-34)33-16-4-5-17-33)21-35-27-20-24(31(37)38)8-9-26(27)29(22-6-2-1-3-7-22)30(35)23-10-14-32-15-11-23/h8-11,14-15,20,22,25H,1-7,12-13,16-19,21H2,(H,37,38)