2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Openeye Name: 2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide CAS Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide IUPAC Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Traditional Name: 2-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide Formula: C19H21ClN2O6S MolecularWeight: 440.89784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)N(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)N(C3=CC(=C(C=C3)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H21ClN2O6S/c1-12(19(23)21-13-4-6-17-18(10-13)28-9-8-27-17)22(29(3,24)25)14-5-7-16(26-2)15(20)11-14/h4-7,10-12H,8-9H2,1-3H3,(H,21,23)