propan-2-yl 2-(acetyloxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: propan-2-yl 2-(acetyloxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: isopropyl 2-(acetoxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2-(acetyloxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(acetyloxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-(acetoxymethyl)-6-(dimethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid isopropyl ester Formula: C21H26N2O8 MolecularWeight: 434.43974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(NC(=CC1C2=CC(=CC=C2)[N+](=O)[O-])C(OC)OC)COC(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=C(NC(=CC1C2=CC(=CC=C2)[N+](=O)[O-])C(OC)OC)COC(=O)C

InChI

InChI=1S/C21H26N2O8/c1-12(2)31-20(25)19-16(14-7-6-8-15(9-14)23(26)27)10-17(21(28-4)29-5)22-18(19)11-30-13(3)24/h6-10,12,16,21-22H,11H2,1-5H3