3-iodanyl-4-methoxy-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzenesulfonamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzenesulfonamide Openeye Name: 3-iodo-4-methoxy-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzenesulfonamide CAS Name: 3-iodo-4-methoxy-N-[[4-(1-pyrrolidinyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 3-iodo-4-methoxy-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzenesulfonamide Traditional Name: 3-iodo-4-methoxy-N-(4-pyrrolidinobenzyl)benzenesulfonamide Formula: C18H21IN2O3S MolecularWeight: 472.34041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N3CCCC3)I

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N3CCCC3)I

InChI

InChI=1S/C18H21IN2O3S/c1-24-18-9-8-16(12-17(18)19)25(22,23)20-13-14-4-6-15(7-5-14)21-10-2-3-11-21/h4-9,12,20H,2-3,10-11,13H2,1H3