2-butyl-3-(4-phenylcyclohexen-1-yl)-1H-indole-6-carboxylic acid

Systemtic Name: 2-butyl-3-(4-phenylcyclohexen-1-yl)-1H-indole-6-carboxylic acid Openeye Name: 2-butyl-3-(4-phenylcyclohexen-1-yl)-1H-indole-6-carboxylic acid CAS Name: 2-butyl-3-(4-phenyl-1-cyclohexenyl)-1H-indole-6-carboxylic acid IUPAC Name: 2-butyl-3-(4-phenylcyclohexen-1-yl)-1H-indole-6-carboxylic acid Traditional Name: 2-butyl-3-(4-phenylcyclohexen-1-yl)-1H-indole-6-carboxylic acid Formula: C25H27NO2 MolecularWeight: 373.48738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(N1)C=C(C=C2)C(=O)O)C3=CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=C(C2=C(N1)C=C(C=C2)C(=O)O)C3=CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO2/c1-2-3-9-22-24(21-15-14-20(25(27)28)16-23(21)26-22)19-12-10-18(11-13-19)17-7-5-4-6-8-17/h4-8,12,14-16,18,26H,2-3,9-11,13H2,1H3,(H,27,28)