ethyl 3-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-oxo-propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-oxopropanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-keto-2-(4-nitrophenyl)propionic acid ethyl ester Formula: C18H15NO7 MolecularWeight: 357.3142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H15NO7/c1-2-24-18(21)16(11-3-6-13(7-4-11)19(22)23)17(20)12-5-8-14-15(9-12)26-10-25-14/h3-9,16H,2,10H2,1H3