[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-butoxy-3-ethoxy-benzoate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-butoxy-3-ethoxy-benzoate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C27H33NO5 MolecularWeight: 451.55462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)OCC

InChI

InChI=1S/C27H33NO5/c1-6-8-15-32-23-14-13-19(16-24(23)31-7-2)26(30)33-18-20(29)17-25-27(3,4)21-11-9-10-12-22(21)28(25)5/h9-14,16-17H,6-8,15,18H2,1-5H3