3-[5-(4-chlorophenyl)pyridin-3-yl]-1-(2-piperidin-1-ylethyl)indole-4-carboxylic acid

Systemtic Name: 3-[5-(4-chlorophenyl)pyridin-3-yl]-1-(2-piperidin-1-ylethyl)indole-4-carboxylic acid Openeye Name: 3-[5-(4-chlorophenyl)-3-pyridyl]-1-[2-(1-piperidyl)ethyl]indole-4-carboxylic acid CAS Name: 3-[5-(4-chlorophenyl)-3-pyridinyl]-1-[2-(1-piperidinyl)ethyl]-4-indolecarboxylic acid IUPAC Name: 3-[5-(4-chlorophenyl)pyridin-3-yl]-1-(2-piperidin-1-ylethyl)indole-4-carboxylic acid Traditional Name: 3-[5-(4-chlorophenyl)-3-pyridyl]-1-(2-piperidinoethyl)indole-4-carboxylic acid Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C=C(C3=C(C=CC=C32)C(=O)O)C4=CN=CC(=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)CCN2C=C(C3=C(C=CC=C32)C(=O)O)C4=CN=CC(=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H26ClN3O2/c28-22-9-7-19(8-10-22)20-15-21(17-29-16-20)24-18-31(14-13-30-11-2-1-3-12-30)25-6-4-5-23(26(24)25)27(32)33/h4-10,15-18H,1-3,11-14H2,(H,32,33)