[4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-(4-methylpiperidin-1-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-(4-methylpiperidin-1-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonyl-3-nitro-phenyl]-(4-methyl-1-piperidyl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-3-nitrophenyl]-(4-methyl-1-piperidinyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonyl-3-nitrophenyl]-(4-methylpiperidin-1-yl)methanone Traditional Name: (4-brosyl-3-nitro-phenyl)-(4-methylpiperidino)methanone Formula: C19H19BrN2O5S MolecularWeight: 467.33356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN2O5S/c1-13-8-10-21(11-9-13)19(23)14-2-7-18(17(12-14)22(24)25)28(26,27)16-5-3-15(20)4-6-16/h2-7,12-13H,8-11H2,1H3