N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-1-phenethyl-piperazin-2-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-1-phenethyl-piperazin-2-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-1-phenethyl-piperazin-2-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-1-phenethyl-2-piperazinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-1-phenethylpiperazin-2-yl)acetamide Traditional Name: 2-(3-keto-1-phenethyl-piperazin-2-yl)-N-piperonyl-acetamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NCC2=CC3=C(C=C2)OCO3)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NCC2=CC3=C(C=C2)OCO3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4/c26-21(24-14-17-6-7-19-20(12-17)29-15-28-19)13-18-22(27)23-9-11-25(18)10-8-16-4-2-1-3-5-16/h1-7,12,18H,8-11,13-15H2,(H,23,27)(H,24,26)