2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-(4-iodophenyl)propanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-(4-iodophenyl)propanamide Openeye Name: 2-(4-ethoxy-N-methylsulfonyl-anilino)-N-(4-iodophenyl)propanamide CAS Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-(4-iodophenyl)propanamide IUPAC Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-(4-iodophenyl)propanamide Traditional Name: 2-(4-ethoxy-N-mesyl-anilino)-N-(4-iodophenyl)propionamide Formula: C18H21IN2O4S MolecularWeight: 488.33981

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)I)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)I)S(=O)(=O)C

InChI

InChI=1S/C18H21IN2O4S/c1-4-25-17-11-9-16(10-12-17)21(26(3,23)24)13(2)18(22)20-15-7-5-14(19)6-8-15/h5-13H,4H2,1-3H3,(H,20,22)