4-(3-ethoxycarbonyl-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitro-phenolate

Systemtic Name: 4-(3-ethoxycarbonyl-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitro-phenolate Openeye Name: 4-(3-ethoxycarbonyl-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitro-phenolate CAS Name: 4-(3-ethoxycarbonyl-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitrophenolate IUPAC Name: 4-(3-ethoxycarbonyl-7,7-dimethyl-2-methylidene-5-oxo-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitrophenolate Traditional Name: 4-(3-carbethoxy-5-keto-7,7-dimethyl-2-methylene-3,4,6,8-tetrahydro-1H-quinolin-4-yl)-2-nitro-phenolate Formula: C21H23N2O6- MolecularWeight: 399.41712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)NC1=C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)NC1=C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O6/c1-5-29-20(26)17-11(2)22-13-9-21(3,4)10-16(25)19(13)18(17)12-6-7-15(24)14(8-12)23(27)28/h6-8,17-18,22,24H,2,5,9-10H2,1,3-4H3/p-1