2-[2-[[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethyl]phenol

Systemtic Name: 2-[2-[[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]amino]ethyl]phenol Openeye Name: 2-[2-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-anilino]ethyl]phenol CAS Name: 2-[2-[4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroanilino]ethyl]phenol IUPAC Name: 2-[2-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroanilino]ethyl]phenol Traditional Name: 2-[2-[4-(4-methylpiperazino)sulfonyl-2-nitro-anilino]ethyl]phenol Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=C3O)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=C3O)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5S/c1-21-10-12-22(13-11-21)29(27,28)16-6-7-17(18(14-16)23(25)26)20-9-8-15-4-2-3-5-19(15)24/h2-7,14,20,24H,8-13H2,1H3