4-[3-(1,3-benzodioxol-5-yl)-3-phenyl-propanoyl]-3,3-dimethyl-piperazin-2-one

Systemtic Name: 4-[3-(1,3-benzodioxol-5-yl)-3-phenyl-propanoyl]-3,3-dimethyl-piperazin-2-one Openeye Name: 4-[3-(1,3-benzodioxol-5-yl)-3-phenyl-propanoyl]-3,3-dimethyl-piperazin-2-one CAS Name: 4-[3-(1,3-benzodioxol-5-yl)-1-oxo-3-phenylpropyl]-3,3-dimethyl-2-piperazinone IUPAC Name: 4-[3-(1,3-benzodioxol-5-yl)-3-phenylpropanoyl]-3,3-dimethylpiperazin-2-one Traditional Name: 4-[3-(1,3-benzodioxol-5-yl)-3-phenyl-propanoyl]-3,3-dimethyl-piperazin-2-one Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)CC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)CC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H24N2O4/c1-22(2)21(26)23-10-11-24(22)20(25)13-17(15-6-4-3-5-7-15)16-8-9-18-19(12-16)28-14-27-18/h3-9,12,17H,10-11,13-14H2,1-2H3,(H,23,26)