2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-1-(phenylmethyl)indole-6-carboxylic acid

Systemtic Name: 2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-1-(phenylmethyl)indole-6-carboxylic acid Openeye Name: 1-benzyl-2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)indole-6-carboxylic acid CAS Name: 2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)-1-(phenylmethyl)-6-indolecarboxylic acid IUPAC Name: 1-benzyl-2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)indole-6-carboxylic acid Traditional Name: 1-benzyl-2-butyl-3-(5-methoxy-3,4-dihydronaphthalen-1-yl)indole-6-carboxylic acid Formula: C31H31NO3 MolecularWeight: 465.58274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(N1CC3=CC=CC=C3)C=C(C=C2)C(=O)O)C4=CCCC5=C4C=CC=C5OC

Isomeric SMILES

CCCCC1=C(C2=C(N1CC3=CC=CC=C3)C=C(C=C2)C(=O)O)C4=CCCC5=C4C=CC=C5OC

InChI

InChI=1S/C31H31NO3/c1-3-4-15-27-30(25-14-8-13-24-23(25)12-9-16-29(24)35-2)26-18-17-22(31(33)34)19-28(26)32(27)20-21-10-6-5-7-11-21/h5-7,9-12,14,16-19H,3-4,8,13,15,20H2,1-2H3,(H,33,34)