5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-2-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-yl]-3,4-dihydro-1H-pyridine-3-carboxylic acid

Systemtic Name: 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-2-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-yl]-3,4-dihydro-1H-pyridine-3-carboxylic acid Openeye Name: 5-methoxycarbonyl-2,6-dimethyl-2-[(E)-1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)allyl]-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid CAS Name: 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-2-[(E)-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-yl]-3,4-dihydro-1H-pyridine-3-carboxylic acid IUPAC Name: 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-2-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-yl]-3,4-dihydro-1H-pyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-2,6-dimethyl-2-[(E)-1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)allyl]-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid Formula: C29H38N2O6 MolecularWeight: 510.62182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(C)C2(C(C(C(=C(N2)C)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(C)C2(C(C(C(=C(N2)C)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C29H38N2O6/c1-17-10-9-15-28(4,5)22(17)14-13-18(2)29(6)25(26(32)33)24(23(19(3)30-29)27(34)37-7)20-11-8-12-21(16-20)31(35)36/h8,11-14,16,18,24-25,30H,9-10,15H2,1-7H3,(H,32,33)/b14-13+