N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C23H29N3O7S MolecularWeight: 491.55726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C23H29N3O7S/c1-16-9-12-25(13-10-16)34(30,31)19-6-4-17(5-7-19)23(27)24-11-8-18-14-21(32-2)22(33-3)15-20(18)26(28)29/h4-7,14-16H,8-13H2,1-3H3,(H,24,27)