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

Systemtic Name: 3-cyclohexyl-1-[2-oxidanylidene-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-thiophen-2-yl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-oxo-2-(4-pyrrolidin-1-yl-1-piperidyl)ethyl]-2-(2-thienyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-oxo-2-[4-(1-pyrrolidinyl)-1-piperidinyl]ethyl]-2-thiophen-2-yl-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-oxo-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-thiophen-2-ylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-keto-2-(4-pyrrolidinopiperidino)ethyl]-2-(2-thienyl)indole-6-carboxylic acid Formula: C30H37N3O3S MolecularWeight: 519.69808

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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=CS6

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCC(CC4)N5CCCC5)C6=CC=CS6

InChI

InChI=1S/C30H37N3O3S/c34-27(32-16-12-23(13-17-32)31-14-4-5-15-31)20-33-25-19-22(30(35)36)10-11-24(25)28(21-7-2-1-3-8-21)29(33)26-9-6-18-37-26/h6,9-11,18-19,21,23H,1-5,7-8,12-17,20H2,(H,35,36)