aminocarbonyl 1-butyl-2,6-dimethyl-4-(2-nitrophenyl)-5-propan-2-yl-4H-pyridine-3-carboxylate

Systemtic Name: aminocarbonyl 1-butyl-2,6-dimethyl-4-(2-nitrophenyl)-5-propan-2-yl-4H-pyridine-3-carboxylate Openeye Name: carbamoyl 1-butyl-5-isopropyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 1-butyl-2,6-dimethyl-4-(2-nitrophenyl)-5-propan-2-yl-4H-pyridine-3-carboxylic acid carbamoyl ester IUPAC Name: carbamoyl 1-butyl-2,6-dimethyl-4-(2-nitrophenyl)-5-propan-2-yl-4H-pyridine-3-carboxylate Traditional Name: 1-butyl-5-isopropyl-2,6-dimethyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid carbamoyl ester Formula: C22H29N3O5 MolecularWeight: 415.48276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(C(=C1C)C(=O)OC(=O)N)C2=CC=CC=C2[N+](=O)[O-])C(C)C)C

Isomeric SMILES

CCCCN1C(=C(C(C(=C1C)C(=O)OC(=O)N)C2=CC=CC=C2[N+](=O)[O-])C(C)C)C

InChI

InChI=1S/C22H29N3O5/c1-6-7-12-24-14(4)18(13(2)3)20(16-10-8-9-11-17(16)25(28)29)19(15(24)5)21(26)30-22(23)27/h8-11,13,20H,6-7,12H2,1-5H3,(H2,23,27)