ethyl (2Z)-2-[(1,2-dimethyl-5-nitro-indol-3-yl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2Z)-2-[(1,2-dimethyl-5-nitro-indol-3-yl)methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2Z)-2-[(1,2-dimethyl-5-nitro-indol-3-yl)methylene]-3-oxo-butanoate CAS Name: (2Z)-2-[(1,2-dimethyl-5-nitro-3-indolyl)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(1,2-dimethyl-5-nitroindol-3-yl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-(1,2-dimethyl-5-nitro-indol-3-yl)acrylic acid ethyl ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C\C1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C)/C(=O)C

InChI

InChI=1S/C17H18N2O5/c1-5-24-17(21)14(11(3)20)9-13-10(2)18(4)16-7-6-12(19(22)23)8-15(13)16/h6-9H,5H2,1-4H3/b14-9-