ethyl 3-dodecanoyl-1-[[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]methyl]indole-2-carboxylate

Systemtic Name: ethyl 3-dodecanoyl-1-[[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 3-dodecanoyl-1-[[3-(3-ethoxy-3-oxo-propyl)phenyl]methyl]indole-2-carboxylate CAS Name: 1-[[3-(3-ethoxy-3-oxopropyl)phenyl]methyl]-3-(1-oxododecyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-dodecanoyl-1-[[3-(3-ethoxy-3-oxopropyl)phenyl]methyl]indole-2-carboxylate Traditional Name: 1-[3-(3-ethoxy-3-keto-propyl)benzyl]-3-lauroyl-indole-2-carboxylic acid ethyl ester Formula: C35H47NO5 MolecularWeight: 561.75138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC(=C3)CCC(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC(=C3)CCC(=O)OCC)C(=O)OCC

InChI

InChI=1S/C35H47NO5/c1-4-7-8-9-10-11-12-13-14-22-31(37)33-29-20-15-16-21-30(29)36(34(33)35(39)41-6-3)26-28-19-17-18-27(25-28)23-24-32(38)40-5-2/h15-21,25H,4-14,22-24,26H2,1-3H3