N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C21H24ClN3O5S MolecularWeight: 465.95036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H24ClN3O5S/c1-15-4-3-11-24(13-15)31(29,30)19-8-5-16(6-9-19)21(26)23(2)14-17-12-18(25(27)28)7-10-20(17)22/h5-10,12,15H,3-4,11,13-14H2,1-2H3