O3-methyl O5-[7-(5-methyl-1,2-oxazol-3-yl)heptyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-[7-(5-methyl-1,2-oxazol-3-yl)heptyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-[7-(5-methylisoxazol-3-yl)heptyl] 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-methyl ester O5-[7-(5-methyl-3-isoxazolyl)heptyl] ester IUPAC Name: 3-O-methyl 5-O-[7-(5-methyl-1,2-oxazol-3-yl)heptyl] 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 O3-methyl ester O5-[7-(5-methylisoxazol-3-yl)heptyl] ester Formula: C27H33N3O7 MolecularWeight: 511.56682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CCCCCCCOC(=O)C2=C(NC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=NO1)CCCCCCCOC(=O)C2=C(NC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C)C

InChI

InChI=1S/C27H33N3O7/c1-17-15-21(29-37-17)12-8-6-5-7-9-14-36-27(32)24-19(3)28-18(2)23(26(31)35-4)25(24)20-11-10-13-22(16-20)30(33)34/h10-11,13,15-16,25,28H,5-9,12,14H2,1-4H3