(2E,12E)-13-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-trideca-2,12-dien-1-one

Systemtic Name: (2E,12E)-13-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-trideca-2,12-dien-1-one Openeye Name: (2E,12E)-13-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-trideca-2,12-dien-1-one CAS Name: (2E,12E)-13-(1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)-1-trideca-2,12-dienone IUPAC Name: (2E,12E)-13-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yltrideca-2,12-dien-1-one Traditional Name: (2E,12E)-13-(1,3-benzodioxol-5-yl)-1-pyrrolidino-trideca-2,12-dien-1-one Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C=CCCCCCCCCC=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCN(C1)C(=O)/C=C/CCCCCCCC/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C24H33NO3/c26-24(25-17-11-12-18-25)14-10-8-6-4-2-1-3-5-7-9-13-21-15-16-22-23(19-21)28-20-27-22/h9-10,13-16,19H,1-8,11-12,17-18,20H2/b13-9+,14-10+