2-[4-[3-(phenylmethyl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid

Systemtic Name: 2-[4-[3-(phenylmethyl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid Openeye Name: 2-[4-(3-benzyl-1-piperidyl)butyl]-1H-indole-5-carboxylic acid CAS Name: 2-[4-[3-(phenylmethyl)-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid IUPAC Name: 2-[4-(3-benzylpiperidin-1-yl)butyl]-1H-indole-5-carboxylic acid Traditional Name: 2-[4-(3-benzylpiperidino)butyl]-1H-indole-5-carboxylic acid Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCCC2=CC3=C(N2)C=CC(=C3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CCCCC2=CC3=C(N2)C=CC(=C3)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O2/c28-25(29)21-11-12-24-22(16-21)17-23(26-24)10-4-5-13-27-14-6-9-20(18-27)15-19-7-2-1-3-8-19/h1-3,7-8,11-12,16-17,20,26H,4-6,9-10,13-15,18H2,(H,28,29)