3-[3-(1,3-benzodioxol-5-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[3-(1,3-benzodioxol-5-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[3-(1,3-benzodioxol-5-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[3-(1,3-benzodioxol-5-yl)propanoylamino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[3-(1,3-benzodioxol-5-yl)propanoylamino]-4-pyrrolidino-benzamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23N3O4/c22-21(26)15-5-6-17(24-9-1-2-10-24)16(12-15)23-20(25)8-4-14-3-7-18-19(11-14)28-13-27-18/h3,5-7,11-12H,1-2,4,8-10,13H2,(H2,22,26)(H,23,25)