N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[(6-pyrrolidino-3-pyridyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)CNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H23N3O4S/c23-27(24,16-5-6-17-18(12-16)26-11-3-10-25-17)21-14-15-4-7-19(20-13-15)22-8-1-2-9-22/h4-7,12-13,21H,1-3,8-11,14H2