5-cyclohexyloxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-cyclohexyloxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-(cyclohexoxycarbonyl)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-[cyclohexyloxy(oxo)methyl]-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-cyclohexyloxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-(cyclohexoxycarbonyl)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C21H24N2O6 MolecularWeight: 400.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCCC2)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCCC2)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

InChI

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