1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazine hydrochloride

Systemtic Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazine hydrochloride Openeye Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazine hydrochloride CAS Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-methyl-2-phenylpiperazine hydrochloride IUPAC Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-methyl-2-phenylpiperazine hydrochloride Traditional Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-methyl-2-phenyl-piperazine hydrochloride Formula: C19H24ClN3O4S MolecularWeight: 425.92956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2C3=CC=CC=C3)C)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2C3=CC=CC=C3)C)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H23N3O4S.ClH/c1-14-11-17(22(23)24)12-19(15(14)2)27(25,26)21-10-9-20(3)13-18(21)16-7-5-4-6-8-16;/h4-8,11-12,18H,9-10,13H2,1-3H3;1H