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

Systemtic Name: 1-[4-[4-(cyclopropylamino)-3-nitro-phenyl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[4-(cyclopropylamino)-3-nitro-benzoyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[[4-(cyclopropylamino)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[4-(cyclopropylamino)-3-nitrobenzoyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[4-(cyclopropylamino)-3-nitro-benzoyl]piperazino]-2-methyl-propan-1-one Formula: C18H24N4O4 MolecularWeight: 360.40756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4/c1-12(2)17(23)20-7-9-21(10-8-20)18(24)13-3-6-15(19-14-4-5-14)16(11-13)22(25)26/h3,6,11-12,14,19H,4-5,7-10H2,1-2H3