2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(esyl)amino]-N-(3-pyrrolidinopropyl)acetamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H27N3O5S/c1-2-27(23,24)21(15-6-7-16-17(12-15)26-14-25-16)13-18(22)19-8-5-11-20-9-3-4-10-20/h6-7,12H,2-5,8-11,13-14H2,1H3,(H,19,22)