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

Systemtic Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(oxan-2-yloxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-tetrahydropyran-2-yloxycarbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[2-oxanyloxy(oxo)methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(oxan-2-yloxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-tetrahydropyran-2-yloxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C20H22N2O7 MolecularWeight: 402.39788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCCO2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCCO2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H22N2O7/c1-11-16(19(23)24)18(13-6-5-7-14(10-13)22(26)27)17(12(2)21-11)20(25)29-15-8-3-4-9-28-15/h5-7,10,15,18,21H,3-4,8-9H2,1-2H3,(H,23,24)