dimethyl 2,6-dimethyl-4-[4-(2-nitrooxyethylcarbamoyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-[4-(2-nitrooxyethylcarbamoyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-[4-(2-nitrooxyethylcarbamoyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[4-[(2-nitrooxyethylamino)-oxomethyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-[4-(2-nitrooxyethylcarbamoyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[4-(2-nitrooxyethylcarbamoyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C20H23N3O8 MolecularWeight: 433.41192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O8/c1-11-15(19(25)29-3)17(16(12(2)22-11)20(26)30-4)13-5-7-14(8-6-13)18(24)21-9-10-31-23(27)28/h5-8,17,22H,9-10H2,1-4H3,(H,21,24)