[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methyl-1-benzofuran-2-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methyl-1-benzofuran-2-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methylbenzofuran-2-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-methyl-2-benzofuranyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methyl-1-benzofuran-2-yl)methanone Traditional Name: (3-methylbenzofuran-2-yl)-(4-piperonylpiperazino)methanone Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N2O4/c1-15-17-4-2-3-5-18(17)28-21(15)22(25)24-10-8-23(9-11-24)13-16-6-7-19-20(12-16)27-14-26-19/h2-7,12H,8-11,13-14H2,1H3