(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-methyl-3-(1-piperidylsulfonyl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-methyl-3-(1-piperidinylsulfonyl)phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-methyl-3-piperidin-1-ylsulfonylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-methyl-3-piperidinosulfonyl-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H28N4O5S/c1-18-5-6-19(17-22(18)33(31,32)26-11-3-2-4-12-26)23(28)25-15-13-24(14-16-25)20-7-9-21(10-8-20)27(29)30/h5-10,17H,2-4,11-16H2,1H3