N-(4-iodophenyl)-1-(5-methoxy-2-methyl-phenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-iodophenyl)-1-(5-methoxy-2-methyl-phenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-iodophenyl)-1-(5-methoxy-2-methyl-phenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(4-iodophenyl)-1-(5-methoxy-2-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(4-iodophenyl)-1-(5-methoxy-2-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(4-iodophenyl)-1-(5-methoxy-2-methyl-phenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C19H21IN2O4S MolecularWeight: 500.35051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)OC)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)I

InChI

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