1-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-3-methyl-but-2-en-1-one

Systemtic Name: 1-[2-[2-(1,3-benzodioxol-5-yl)ethanoyl]pyrazolidin-1-yl]-3-methyl-but-2-en-1-one Openeye Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-methyl-but-2-en-1-one CAS Name: 1-[2-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-1-pyrazolidinyl]-3-methyl-2-buten-1-one IUPAC Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-methylbut-2-en-1-one Traditional Name: 1-[2-[2-(1,3-benzodioxol-5-yl)acetyl]pyrazolidin-1-yl]-3-methyl-but-2-en-1-one Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC(=CC(=O)N1CCCN1C(=O)CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H20N2O4/c1-12(2)8-16(20)18-6-3-7-19(18)17(21)10-13-4-5-14-15(9-13)23-11-22-14/h4-5,8-9H,3,6-7,10-11H2,1-2H3