4-[(E)-3-(2,3-dihydro-1H-inden-5-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(E)-3-(2,3-dihydro-1H-inden-5-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(E)-3-indan-5-yl-3-oxo-prop-1-enyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(E)-3-(2,3-dihydro-1H-inden-5-yl)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(E)-3-(2,3-dihydro-1H-inden-5-yl)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(E)-3-indan-5-yl-3-keto-prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C19H16NO5- MolecularWeight: 338.33404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=CC(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C/C(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C19H17NO5/c1-25-18-10-12(9-16(19(18)22)20(23)24)5-8-17(21)15-7-6-13-3-2-4-14(13)11-15/h5-11,22H,2-4H2,1H3/p-1/b8-5+