octyl 2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: octyl 2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: octyl 5-(isopropylcarbamoyl)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(2-nitrophenyl)-5-[oxo-(propan-2-ylamino)methyl]-1,4-dihydropyridine-3-carboxylic acid octyl ester IUPAC Name: octyl 2,6-dimethyl-4-(2-nitrophenyl)-5-(propan-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-(isopropylcarbamoyl)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid octyl ester Formula: C26H37N3O5 MolecularWeight: 471.58908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37N3O5/c1-6-7-8-9-10-13-16-34-26(31)23-19(5)28-18(4)22(25(30)27-17(2)3)24(23)20-14-11-12-15-21(20)29(32)33/h11-12,14-15,17,24,28H,6-10,13,16H2,1-5H3,(H,27,30)