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

Systemtic Name: 2-methyl-1-[4-(3-methyl-2-nitro-phenyl)carbonylpiperazin-1-yl]-2-phenyl-propan-1-one Openeye Name: 2-methyl-1-[4-(3-methyl-2-nitro-benzoyl)piperazin-1-yl]-2-phenyl-propan-1-one CAS Name: 2-methyl-1-[4-[(3-methyl-2-nitrophenyl)-oxomethyl]-1-piperazinyl]-2-phenyl-1-propanone IUPAC Name: 2-methyl-1-[4-(3-methyl-2-nitrobenzoyl)piperazin-1-yl]-2-phenylpropan-1-one Traditional Name: 2-methyl-1-[4-(3-methyl-2-nitro-benzoyl)piperazino]-2-phenyl-propan-1-one Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)C(=O)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)C(=O)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O4/c1-16-8-7-11-18(19(16)25(28)29)20(26)23-12-14-24(15-13-23)21(27)22(2,3)17-9-5-4-6-10-17/h4-11H,12-15H2,1-3H3