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

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

Systemtic Name:3-[2-(2-decoxyphenyl)ethanoyl]-1-methyl-indole-2-carboxylic acid
Openeye Name:3-[2-(2-decoxyphenyl)acetyl]-1-methyl-indole-2-carboxylic acid
CAS Name:3-[2-(2-decoxyphenyl)-1-oxoethyl]-1-methyl-2-indolecarboxylic acid
IUPAC Name:3-[2-(2-decoxyphenyl)acetyl]-1-methylindole-2-carboxylic acid
Traditional Name:3-[2-(2-decoxyphenyl)acetyl]-1-methyl-indole-2-carboxylic acid
Formula: C28H35NO4
MolecularWeight: 449.5818
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC=C1CC(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O


Isomeric SMILES

CCCCCCCCCCOC1=CC=CC=C1CC(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O


InChI

InChI=1S/C28H35NO4/c1-3-4-5-6-7-8-9-14-19-33-25-18-13-10-15-21(25)20-24(30)26-22-16-11-12-17-23(22)29(2)27(26)28(31)32/h10-13,15-18H,3-9,14,19-20H2,1-2H3,(H,31,32)


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