N-[3-[[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[4-(4-methylpiperidino)sulfonyl-2-nitro-anilino]methyl]phenyl]cyclopropanecarboxamide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC(=CC=C3)NC(=O)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC(=CC=C3)NC(=O)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O5S/c1-16-9-11-26(12-10-16)33(31,32)20-7-8-21(22(14-20)27(29)30)24-15-17-3-2-4-19(13-17)25-23(28)18-5-6-18/h2-4,7-8,13-14,16,18,24H,5-6,9-12,15H2,1H3,(H,25,28)