propan-2-yl 2,6-dimethyl-5-nitro-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: propan-2-yl 2,6-dimethyl-5-nitro-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: isopropyl 2,6-dimethyl-5-nitro-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-nitro-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,6-dimethyl-5-nitro-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-nitro-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxylic acid isopropyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O4/c1-9(2)23-16(20)13-10(3)18-11(4)15(19(21)22)14(13)12-5-7-17-8-6-12/h5-9,14,18H,1-4H3