cyclooctyl 6-methyl-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: cyclooctyl 6-methyl-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: cyclooctyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 2-keto-6-methyl-4-(2-nitrophenyl)-3,4-dihydro-1H-pyridine-5-carboxylic acid cyclooctyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC3CCCCCCC3

Isomeric SMILES

CC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC3CCCCCCC3

InChI

InChI=1S/C21H26N2O5/c1-14-20(21(25)28-15-9-5-3-2-4-6-10-15)17(13-19(24)22-14)16-11-7-8-12-18(16)23(26)27/h7-8,11-12,15,17H,2-6,9-10,13H2,1H3,(H,22,24)