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

Systemtic Name: N,N-dimethyl-3-[[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]methyl]benzamide Openeye Name: N,N-dimethyl-3-[[4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]methyl]benzamide CAS Name: N,N-dimethyl-3-[[4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]methyl]benzamide IUPAC Name: N,N-dimethyl-3-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]methyl]benzamide Traditional Name: N,N-dimethyl-3-[[4-(3-methylpiperidino)sulfonyl-2-nitro-anilino]methyl]benzamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC(=C3)C(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC(=C3)C(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O5S/c1-16-6-5-11-25(15-16)32(30,31)19-9-10-20(21(13-19)26(28)29)23-14-17-7-4-8-18(12-17)22(27)24(2)3/h4,7-10,12-13,16,23H,5-6,11,14-15H2,1-3H3