4-(4-chloranyl-3-nitro-phenyl)-5-ethanoyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(4-chloranyl-3-nitro-phenyl)-5-ethanoyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-acetyl-4-(4-chloro-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-acetyl-4-(4-chloro-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-acetyl-4-(4-chloro-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-acetyl-4-(4-chloro-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O5/c1-7-13(9(3)20)15(14(16(21)22)8(2)18-7)10-4-5-11(17)12(6-10)19(23)24/h4-6,15,18H,1-3H3,(H,21,22)