[(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 3-(2-ethoxyphenyl)propanoate

Systemtic Name: [(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 3-(2-ethoxyphenyl)propanoate Openeye Name: [(3E)-2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 3-(2-ethoxyphenyl)propanoate CAS Name: 3-(2-ethoxyphenyl)propanoic acid [(3E)-2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [(3E)-2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 3-(2-ethoxyphenyl)propanoate Traditional Name: 3-o-phenetylpropionic acid [(3E)-2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCC(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1CCC(=O)OCC(=O)/C=C/2\C(C3=CC=CC=C3N2C)(C)C

InChI

InChI=1S/C25H29NO4/c1-5-29-22-13-9-6-10-18(22)14-15-24(28)30-17-19(27)16-23-25(2,3)20-11-7-8-12-21(20)26(23)4/h6-13,16H,5,14-15,17H2,1-4H3/b23-16+