N-(4-iodanyl-2-methyl-phenyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-iodo-2-methylphenyl)-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-iodo-2-methylphenyl)-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-2-methoxy-5-pyrrolidinosulfonyl-benzamide Formula: C19H21IN2O4S MolecularWeight: 500.35051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C19H21IN2O4S/c1-13-11-14(20)5-7-17(13)21-19(23)16-12-15(6-8-18(16)26-2)27(24,25)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)