(3,3-diethyl-6-oxidanylidene-cyclohexen-1-yl) 3-(2-methyl-6-nitro-phenyl)naphthalene-2-carboxylate

Systemtic Name: (3,3-diethyl-6-oxidanylidene-cyclohexen-1-yl) 3-(2-methyl-6-nitro-phenyl)naphthalene-2-carboxylate Openeye Name: (3,3-diethyl-6-oxo-cyclohexen-1-yl) 3-(2-methyl-6-nitro-phenyl)naphthalene-2-carboxylate CAS Name: 3-(2-methyl-6-nitrophenyl)-2-naphthalenecarboxylic acid (3,3-diethyl-6-oxo-1-cyclohexenyl) ester IUPAC Name: (3,3-diethyl-6-oxocyclohexen-1-yl) 3-(2-methyl-6-nitrophenyl)naphthalene-2-carboxylate Traditional Name: 3-(2-methyl-6-nitro-phenyl)naphthalene-2-carboxylic acid (3,3-diethyl-6-keto-cyclohexen-1-yl) ester Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(=O)C(=C1)OC(=O)C2=CC3=CC=CC=C3C=C2C4=C(C=CC=C4[N+](=O)[O-])C)CC

Isomeric SMILES

CCC1(CCC(=O)C(=C1)OC(=O)C2=CC3=CC=CC=C3C=C2C4=C(C=CC=C4[N+](=O)[O-])C)CC

InChI

InChI=1S/C28H27NO5/c1-4-28(5-2)14-13-24(30)25(17-28)34-27(31)22-16-20-11-7-6-10-19(20)15-21(22)26-18(3)9-8-12-23(26)29(32)33/h6-12,15-17H,4-5,13-14H2,1-3H3