N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N,4-dimethyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N,4-dimethyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N,4-dimethyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-N,4-dimethyl-3-piperidinosulfonyl-benzamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27BrN2O4S/c1-16-7-8-17(14-21(16)30(27,28)25-11-5-4-6-12-25)22(26)24(2)15-18-13-19(23)9-10-20(18)29-3/h7-10,13-14H,4-6,11-12,15H2,1-3H3