O3-(2-bromoethyl) O5-cyclopentyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-bromoethyl) O5-cyclopentyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-bromoethyl) O5-cyclopentyl 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-bromoethyl) ester O5-cyclopentyl ester IUPAC Name: 3-O-(2-bromoethyl) 5-O-cyclopentyl 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-(2-bromoethyl) ester O5-cyclopentyl ester Formula: C22H25BrN2O6 MolecularWeight: 493.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCBr

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC2CCCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCBr

InChI

InChI=1S/C22H25BrN2O6/c1-13-18(21(26)30-11-10-23)20(15-6-5-7-16(12-15)25(28)29)19(14(2)24-13)22(27)31-17-8-3-4-9-17/h5-7,12,17,20,24H,3-4,8-11H2,1-2H3