[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-(hydroxymethyl)-5-oxidanylidene-oxolan-2-yl]methyl heptanoate

Systemtic Name: [(4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-(hydroxymethyl)-5-oxidanylidene-oxolan-2-yl]methyl heptanoate Openeye Name: [(4Z)-4-[(4-dimethylaminophenyl)methylene]-2-(hydroxymethyl)-5-oxo-tetrahydrofuran-2-yl]methyl heptanoate CAS Name: heptanoic acid [(4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-(hydroxymethyl)-5-oxo-2-oxolanyl]methyl ester IUPAC Name: [(4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-(hydroxymethyl)-5-oxooxolan-2-yl]methyl heptanoate Traditional Name: enanthic acid [(4Z)-4-[4-(dimethylamino)benzylidene]-5-keto-2-methylol-tetrahydrofuran-2-yl]methyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCC1(CC(=CC2=CC=C(C=C2)N(C)C)C(=O)O1)CO

Isomeric SMILES

CCCCCCC(=O)OCC1(C/C(=C/C2=CC=C(C=C2)N(C)C)/C(=O)O1)CO

InChI

InChI=1S/C22H31NO5/c1-4-5-6-7-8-20(25)27-16-22(15-24)14-18(21(26)28-22)13-17-9-11-19(12-10-17)23(2)3/h9-13,24H,4-8,14-16H2,1-3H3/b18-13-