N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[4-(pyrrolidinomethyl)benzyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H24N2O4S/c23-27(24,18-7-8-19-20(13-18)26-12-11-25-19)21-14-16-3-5-17(6-4-16)15-22-9-1-2-10-22/h3-8,13,21H,1-2,9-12,14-15H2