[4-(3-methylphenyl)piperazin-1-yl]-(4-morpholin-4-yl-3-nitro-phenyl)methanone

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-(4-morpholin-4-yl-3-nitro-phenyl)methanone Openeye Name: (4-morpholino-3-nitro-phenyl)-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-[4-(4-morpholinyl)-3-nitrophenyl]methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-(4-morpholin-4-yl-3-nitrophenyl)methanone Traditional Name: (4-morpholino-3-nitro-phenyl)-[4-(m-tolyl)piperazino]methanone Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-17-3-2-4-19(15-17)23-7-9-25(10-8-23)22(27)18-5-6-20(21(16-18)26(28)29)24-11-13-30-14-12-24/h2-6,15-16H,7-14H2,1H3