[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylimidazol-4-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylimidazol-4-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylimidazol-4-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-phenyl-4-imidazolyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylimidazol-4-yl)methanone Traditional Name: (3-phenylimidazol-4-yl)-(4-piperonylpiperazino)methanone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=CN4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CN=CN4C5=CC=CC=C5

InChI

InChI=1S/C22H22N4O3/c27-22(19-13-23-15-26(19)18-4-2-1-3-5-18)25-10-8-24(9-11-25)14-17-6-7-20-21(12-17)29-16-28-20/h1-7,12-13,15H,8-11,14,16H2