2-(iodanylmethyl)-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid

Systemtic Name: 2-(iodanylmethyl)-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid Openeye Name: 2-(iodomethyl)-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid CAS Name: 2-(iodomethyl)-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid IUPAC Name: 2-(iodomethyl)-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-2-(iodomethyl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid Formula: C17H19IN2O6 MolecularWeight: 474.24703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19IN2O6/c1-9-12(16(23)26-3)13(10-5-4-6-11(7-10)20(24)25)14(15(21)22)17(2,8-18)19-9/h4-7,13-14,19H,8H2,1-3H3,(H,21,22)