1,3-dimethyl-5-nitro-6-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]benzimidazol-2-one

Systemtic Name: 1,3-dimethyl-5-nitro-6-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]benzimidazol-2-one Openeye Name: 5-[4-(4-isopropylbenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 1,3-dimethyl-5-nitro-6-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]-2-benzimidazolone IUPAC Name: 1,3-dimethyl-5-nitro-6-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]benzimidazol-2-one Traditional Name: 5-(4-cumoylpiperazino)-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O4/c1-15(2)16-5-7-17(8-6-16)22(29)27-11-9-26(10-12-27)20-13-18-19(14-21(20)28(31)32)25(4)23(30)24(18)3/h5-8,13-15H,9-12H2,1-4H3