5-ethanoyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-ethanoyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-acetyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-acetyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-acetyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-acetyl-2,6-diethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(N1)CC)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCC1=C(C(C(=C(N1)CC)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C18H20N2O5/c1-4-12-15(10(3)21)16(17(18(22)23)13(5-2)19-12)11-8-6-7-9-14(11)20(24)25/h6-9,16,19H,4-5H2,1-3H3,(H,22,23)