4-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]phenol

Systemtic Name: 4-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]phenol Openeye Name: 4-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]phenol CAS Name: 4-[4-(4-methyl-3-nitrophenyl)sulfonyl-1-piperazinyl]phenol IUPAC Name: 4-[4-(4-methyl-3-nitrophenyl)sulfonylpiperazin-1-yl]phenol Traditional Name: 4-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazino]phenol Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5S/c1-13-2-7-16(12-17(13)20(22)23)26(24,25)19-10-8-18(9-11-19)14-3-5-15(21)6-4-14/h2-7,12,21H,8-11H2,1H3