N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(4-pyrrolidin-1-ylbutyl)naphthalene-2-sulfonamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(4-pyrrolidin-1-ylbutyl)naphthalene-2-sulfonamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(4-pyrrolidin-1-ylbutyl)naphthalene-2-sulfonamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-[4-(1-pyrrolidinyl)butyl]-2-naphthalenesulfonamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(4-pyrrolidin-1-ylbutyl)naphthalene-2-sulfonamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(4-pyrrolidinobutyl)naphthalene-2-sulfonamide Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCN(CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)CCCCN(CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H32N2O4S/c30-34(31,25-11-10-23-7-1-2-8-24(23)20-25)29(16-6-5-15-28-13-3-4-14-28)21-22-9-12-26-27(19-22)33-18-17-32-26/h1-2,7-12,19-20H,3-6,13-18,21H2