N-(3-iodanyl-4-methyl-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-iodo-4-methylphenyl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-iodo-4-methylphenyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C20H23IN2O3S MolecularWeight: 498.37769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)I)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)I)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H23IN2O3S/c1-14-7-9-17(13-18(14)21)22-20(24)16-8-6-15(2)19(12-16)27(25,26)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,24)