(4-ethoxyphenyl)-[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]methanone

Systemtic Name: (4-ethoxyphenyl)-[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]methanone Openeye Name: (4-ethoxyphenyl)-[2-(4-methyl-1-piperidyl)-5-nitro-phenyl]methanone CAS Name: (4-ethoxyphenyl)-[2-(4-methyl-1-piperidinyl)-5-nitrophenyl]methanone IUPAC Name: (4-ethoxyphenyl)-[2-(4-methylpiperidin-1-yl)-5-nitrophenyl]methanone Traditional Name: [2-(4-methylpiperidino)-5-nitro-phenyl]-p-phenetyl-methanone Formula: C21H24N2O4 MolecularWeight: 368.42626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)C

InChI

InChI=1S/C21H24N2O4/c1-3-27-18-7-4-16(5-8-18)21(24)19-14-17(23(25)26)6-9-20(19)22-12-10-15(2)11-13-22/h4-9,14-15H,3,10-13H2,1-2H3