ethyl 3-(4-dodecoxyphenyl)carbonyl-1-methyl-indole-2-carboxylate

Systemtic Name: ethyl 3-(4-dodecoxyphenyl)carbonyl-1-methyl-indole-2-carboxylate Openeye Name: ethyl 3-(4-dodecoxybenzoyl)-1-methyl-indole-2-carboxylate CAS Name: 3-[(4-dodecoxyphenyl)-oxomethyl]-1-methyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-dodecoxybenzoyl)-1-methylindole-2-carboxylate Traditional Name: 3-(4-lauryloxybenzoyl)-1-methyl-indole-2-carboxylic acid ethyl ester Formula: C31H41NO4 MolecularWeight: 491.66154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)OCC

InChI

InChI=1S/C31H41NO4/c1-4-6-7-8-9-10-11-12-13-16-23-36-25-21-19-24(20-22-25)30(33)28-26-17-14-15-18-27(26)32(3)29(28)31(34)35-5-2/h14-15,17-22H,4-13,16,23H2,1-3H3