1-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazino]-2-methyl-propan-1-one Formula: C15H20ClN3O5S MolecularWeight: 389.8544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C(C)C)Cl

InChI

InChI=1S/C15H20ClN3O5S/c1-10(2)15(20)17-4-6-18(7-5-17)25(23,24)12-8-13(16)11(3)14(9-12)19(21)22/h8-10H,4-7H2,1-3H3