3-[3-(2-decoxyphenyl)propanoyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[3-(2-decoxyphenyl)propanoyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[3-(2-decoxyphenyl)propanoyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[3-(2-decoxyphenyl)-1-oxopropyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[3-(2-decoxyphenyl)propanoyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[3-(2-decoxyphenyl)propanoyl]-1-methyl-indole-2-carboxylic acid Formula: C29H37NO4 MolecularWeight: 463.60838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC=C1CCC(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC=C1CCC(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C29H37NO4/c1-3-4-5-6-7-8-9-14-21-34-26-18-13-10-15-22(26)19-20-25(31)27-23-16-11-12-17-24(23)30(2)28(27)29(32)33/h10-13,15-18H,3-9,14,19-21H2,1-2H3,(H,32,33)