4-nitro-N-[3-oxidanylidene-3-[(3-piperidin-1-ylsulfonylphenyl)amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[(3-piperidin-1-ylsulfonylphenyl)amino]propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-[3-(1-piperidylsulfonyl)anilino]propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-[3-(1-piperidinylsulfonyl)anilino]propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(3-piperidin-1-ylsulfonylanilino)propyl]benzamide Traditional Name: N-[3-keto-3-(3-piperidinosulfonylanilino)propyl]-4-nitro-benzamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O6S/c26-20(11-12-22-21(27)16-7-9-18(10-8-16)25(28)29)23-17-5-4-6-19(15-17)32(30,31)24-13-2-1-3-14-24/h4-10,15H,1-3,11-14H2,(H,22,27)(H,23,26)