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

Systemtic Name: dimethyl 4-[2-(2,3-dinitrooxybutan-2-ylcarbamoyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-[2-[(1-methyl-1,2-dinitrooxy-propyl)carbamoyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-[2-[(2,3-dinitrooxybutan-2-ylamino)-oxomethyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[2-(2,3-dinitrooxybutan-2-ylcarbamoyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[2-[(1-methyl-1,2-dinitrooxy-propyl)carbamoyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H26N4O11 MolecularWeight: 522.46204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2C(=O)NC(C)(C(C)O[N+](=O)[O-])O[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2C(=O)NC(C)(C(C)O[N+](=O)[O-])O[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H26N4O11/c1-11-16(20(28)34-5)18(17(12(2)23-11)21(29)35-6)14-9-7-8-10-15(14)19(27)24-22(4,37-26(32)33)13(3)36-25(30)31/h7-10,13,18,23H,1-6H3,(H,24,27)