ethyl 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-oxo-butanoate CAS Name: 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-oxobutanoate Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-(4-dimethylaminophenyl)-4-keto-butyric acid ethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC2=C(C=C1)OCO2)C(C=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCOC(=O)C(C1=CC2=C(C=C1)OCO2)C(C=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H23NO5/c1-4-25-21(24)20(15-7-10-18-19(11-15)27-13-26-18)17(12-23)14-5-8-16(9-6-14)22(2)3/h5-12,17,20H,4,13H2,1-3H3