1-[3-[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]phenyl]ethanone

Systemtic Name: 1-[3-[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]phenyl]ethanone Openeye Name: 1-[3-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]phenyl]ethanone CAS Name: 1-[3-[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]phenyl]ethanone IUPAC Name: 1-[3-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]phenyl]ethanone Traditional Name: 1-[3-[4-(4-methylpiperidino)sulfonyl-2-nitro-anilino]phenyl]ethanone Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC=CC(=C3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC=CC(=C3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-14-8-10-22(11-9-14)29(27,28)18-6-7-19(20(13-18)23(25)26)21-17-5-3-4-16(12-17)15(2)24/h3-7,12-14,21H,8-11H2,1-2H3