ethyl 3-dodecanoyl-1-[[4-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl]methyl]indole-2-carboxylate

Systemtic Name: ethyl 3-dodecanoyl-1-[[4-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 3-dodecanoyl-1-[[4-[(E)-3-ethoxy-3-oxo-prop-1-enyl]phenyl]methyl]indole-2-carboxylate CAS Name: 1-[[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl]methyl]-3-(1-oxododecyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-dodecanoyl-1-[[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl]methyl]indole-2-carboxylate Traditional Name: 1-[4-[(E)-3-ethoxy-3-keto-prop-1-enyl]benzyl]-3-lauroyl-indole-2-carboxylic acid ethyl ester Formula: C35H45NO5 MolecularWeight: 559.7355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H45NO5/c1-4-7-8-9-10-11-12-13-14-19-31(37)33-29-17-15-16-18-30(29)36(34(33)35(39)41-6-3)26-28-22-20-27(21-23-28)24-25-32(38)40-5-2/h15-18,20-25H,4-14,19,26H2,1-3H3/b25-24+