[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-morpholino-5-nitro-phenyl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(4-morpholinyl)-5-nitrophenyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitrophenyl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(2-morpholino-5-nitro-phenyl)methanone Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O4/c1-17-4-3-5-21(18(17)2)24-8-10-26(11-9-24)23(28)20-16-19(27(29)30)6-7-22(20)25-12-14-31-15-13-25/h3-7,16H,8-15H2,1-2H3