4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(oxolan-2-ylmethyl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(oxolan-2-ylmethyl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(tetrahydrofuran-2-ylmethyl)butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(2-oxolanylmethyl)butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(oxolan-2-ylmethyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(tetrahydrofurfuryl)butyramide Formula: C17H25ClN2O5S MolecularWeight: 404.9088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCCC(=O)NCC2CCCO2)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)NCC2CCCO2)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H25ClN2O5S/c1-24-16-8-7-13(11-15(16)18)20(26(2,22)23)9-3-6-17(21)19-12-14-5-4-10-25-14/h7-8,11,14H,3-6,9-10,12H2,1-2H3,(H,19,21)