2-chloranyl-1-[5-ethanoyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]pentan-1-one

Systemtic Name: 2-chloranyl-1-[5-ethanoyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]pentan-1-one Openeye Name: 1-[5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-2-chloro-pentan-1-one CAS Name: 1-[5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-2-chloro-1-pentanone IUPAC Name: 1-[5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-2-chloropentan-1-one Traditional Name: 1-[5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-2-chloro-pentan-1-one Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O4/c1-5-7-16(21)20(25)18-12(3)22-11(2)17(13(4)24)19(18)14-8-6-9-15(10-14)23(26)27/h6,8-10,16,19,22H,5,7H2,1-4H3