1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-methylbutyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-methylbutyl)pyrrolidine-2-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-isopentyl-pyrrolidine-2-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-methylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-methylbutyl)pyrrolidine-2-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-isoamyl-pyrrolidine-2-carboxamide Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)CCNC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H26N2O5S/c1-13(2)7-8-19-18(21)15-4-3-9-20(15)26(22,23)14-5-6-16-17(12-14)25-11-10-24-16/h5-6,12-13,15H,3-4,7-11H2,1-2H3,(H,19,21)