1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(1,2-benzoxazol-3-yl)ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone Traditional Name: 2-indoxazen-3-yl-1-(4-piperonylpiperazino)ethanone Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CC4=NOC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CC4=NOC5=CC=CC=C54

InChI

InChI=1S/C21H21N3O4/c25-21(12-17-16-3-1-2-4-18(16)28-22-17)24-9-7-23(8-10-24)13-15-5-6-19-20(11-15)27-14-26-19/h1-6,11H,7-10,12-14H2