[5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (3-methyl-1-propan-2-yl-cyclohexyl) carbonate

Systemtic Name: [5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (3-methyl-1-propan-2-yl-cyclohexyl) carbonate Openeye Name: [5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (1-isopropyl-3-methyl-cyclohexyl) carbonate CAS Name: carbonic acid [5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (3-methyl-1-propan-2-ylcyclohexyl) ester IUPAC Name: [5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (3-methyl-1-propan-2-ylcyclohexyl) carbonate Traditional Name: carbonic acid [5-carboxyoxy-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl] (1-isopropyl-3-methyl-cyclohexyl) ester Formula: C25H32N2O8 MolecularWeight: 488.53018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C(C)C)OC(=O)OC2=C(NC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])OC(=O)O)C)C

Isomeric SMILES

CC1CCCC(C1)(C(C)C)OC(=O)OC2=C(NC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])OC(=O)O)C)C

InChI

InChI=1S/C25H32N2O8/c1-14(2)25(11-7-8-15(3)13-25)35-24(30)34-22-17(5)26-16(4)21(33-23(28)29)20(22)18-9-6-10-19(12-18)27(31)32/h6,9-10,12,14-15,20,26H,7-8,11,13H2,1-5H3,(H,28,29)