O5-propan-2-yl O3-undecyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-propan-2-yl O3-undecyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-undecyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-propan-2-yl ester O3-undecyl ester IUPAC Name: 5-O-propan-2-yl 3-O-undecyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-undecyl ester Formula: C29H42N2O6 MolecularWeight: 514.65358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)C)C

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)C)C

InChI

InChI=1S/C29H42N2O6/c1-6-7-8-9-10-11-12-13-14-18-36-28(32)25-21(4)30-22(5)26(29(33)37-20(2)3)27(25)23-16-15-17-24(19-23)31(34)35/h15-17,19-20,27,30H,6-14,18H2,1-5H3