(2S)-1-[2-(1,3-benzodioxol-5-yl)ethanoyl]-N-propyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)ethanoyl]-N-propyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-propyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-N-propyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-propylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-propyl-pyrrolidine-2-carboxamide Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCNC(=O)[C@@H]1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H22N2O4/c1-2-7-18-17(21)13-4-3-8-19(13)16(20)10-12-5-6-14-15(9-12)23-11-22-14/h5-6,9,13H,2-4,7-8,10-11H2,1H3,(H,18,21)/t13-/m0/s1