N-(1,3-benzodioxol-5-yl)-4-[(3-chlorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-[(3-chlorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(3-chloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(3-chloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(3-chloro-N-methylsulfonylanilino)butanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(3-chloro-N-mesyl-anilino)butyramide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NC1=CC2=C(C=C1)OCO2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NC1=CC2=C(C=C1)OCO2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H19ClN2O5S/c1-27(23,24)21(15-5-2-4-13(19)10-15)9-3-6-18(22)20-14-7-8-16-17(11-14)26-12-25-16/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3,(H,20,22)