4-bromanyl-3-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-nitrophenyl)benzamide

Systemtic Name: 4-bromanyl-3-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-nitrophenyl)benzamide Openeye Name: 4-bromo-3-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(3-nitrophenyl)benzamide CAS Name: 4-bromo-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(3-nitrophenyl)benzamide IUPAC Name: 4-bromo-3-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-nitrophenyl)benzamide Traditional Name: 4-bromo-3-(3,5-dimethylpiperidino)sulfonyl-N-(3-nitrophenyl)benzamide Formula: C20H22BrN3O5S MolecularWeight: 496.37478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C20H22BrN3O5S/c1-13-8-14(2)12-23(11-13)30(28,29)19-9-15(6-7-18(19)21)20(25)22-16-4-3-5-17(10-16)24(26)27/h3-7,9-10,13-14H,8,11-12H2,1-2H3,(H,22,25)