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

Systemtic Name: O3-(2-octoxyethyl) O5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(2-octoxyethyl) 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 O3-(2-octoxyethyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(2-octoxyethyl) 5-O-propan-2-yl 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-(2-octoxyethyl) ester Formula: C28H40N2O7 MolecularWeight: 516.6264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N2O7/c1-6-7-8-9-10-11-15-35-16-17-36-27(31)24-20(4)29-21(5)25(28(32)37-19(2)3)26(24)22-13-12-14-23(18-22)30(33)34/h12-14,18-19,26,29H,6-11,15-17H2,1-5H3