3-(2-dodecoxyphenyl)carbonyl-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-(2-dodecoxyphenyl)carbonyl-1-methyl-indole-2-carboxylic acid Openeye Name: 3-(2-dodecoxybenzoyl)-1-methyl-indole-2-carboxylic acid CAS Name: 3-[(2-dodecoxyphenyl)-oxomethyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-(2-dodecoxybenzoyl)-1-methylindole-2-carboxylic acid Traditional Name: 3-(2-lauryloxybenzoyl)-1-methyl-indole-2-carboxylic acid Formula: C29H37NO4 MolecularWeight: 463.60838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC=C1C(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC=C1C(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C29H37NO4/c1-3-4-5-6-7-8-9-10-11-16-21-34-25-20-15-13-18-23(25)28(31)26-22-17-12-14-19-24(22)30(2)27(26)29(32)33/h12-15,17-20H,3-11,16,21H2,1-2H3,(H,32,33)