[4-(4-chloranyl-3-nitro-phenyl)carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-(4-chloranyl-3-nitro-phenyl)carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-(4-chloro-3-nitro-benzoyl)piperazin-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-[(4-chloro-3-nitrophenyl)-oxomethyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-(4-chloro-3-nitrobenzoyl)piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-(4-chloro-3-nitro-benzoyl)piperazino]-p-cumenyl-methanone Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O4/c1-14(2)15-3-5-16(6-4-15)20(26)23-9-11-24(12-10-23)21(27)17-7-8-18(22)19(13-17)25(28)29/h3-8,13-14H,9-12H2,1-2H3