2-methyl-1-[4-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[4-(4-methyl-1-piperidyl)-3-nitro-benzoyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[4-(4-methylpiperidin-1-yl)-3-nitrobenzoyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[4-(4-methylpiperidino)-3-nitro-benzoyl]piperazino]propan-1-one Formula: C21H30N4O4 MolecularWeight: 402.4873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O4/c1-15(2)20(26)23-10-12-24(13-11-23)21(27)17-4-5-18(19(14-17)25(28)29)22-8-6-16(3)7-9-22/h4-5,14-16H,6-13H2,1-3H3