ethyl 2,6-dimethyl-5-nitro-4-(2-nonyl-4-oxidanylidene-chromen-8-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-5-nitro-4-(2-nonyl-4-oxidanylidene-chromen-8-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 2,6-dimethyl-5-nitro-4-(2-nonyl-4-oxo-chromen-8-yl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-nitro-4-(2-nonyl-4-oxo-1-benzopyran-8-yl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,6-dimethyl-5-nitro-4-(2-nonyl-4-oxochromen-8-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(4-keto-2-nonyl-chromen-8-yl)-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C28H36N2O6 MolecularWeight: 496.59524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=O)C2=C(O1)C(=CC=C2)C3C(=C(NC(=C3[N+](=O)[O-])C)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCC1=CC(=O)C2=C(O1)C(=CC=C2)C3C(=C(NC(=C3[N+](=O)[O-])C)C)C(=O)OCC

InChI

InChI=1S/C28H36N2O6/c1-5-7-8-9-10-11-12-14-20-17-23(31)21-15-13-16-22(27(21)36-20)25-24(28(32)35-6-2)18(3)29-19(4)26(25)30(33)34/h13,15-17,25,29H,5-12,14H2,1-4H3