2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[4-(2,3-dimethyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-(2,3-dimethyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazino]-1-(2-methylpiperidino)ethanone Formula: C20H30N4O5S MolecularWeight: 438.541

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H30N4O5S/c1-15-12-18(24(26)27)13-19(17(15)3)30(28,29)22-10-8-21(9-11-22)14-20(25)23-7-5-4-6-16(23)2/h12-13,16H,4-11,14H2,1-3H3