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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(methoxymethyl)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(methoxymethyl)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[3-(methoxymethyl)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(methoxymethyl)phenyl]methanone Traditional Name: [3-(methoxymethyl)phenyl]-(4-piperonylpiperazino)methanone Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O4/c1-25-14-17-3-2-4-18(11-17)21(24)23-9-7-22(8-10-23)13-16-5-6-19-20(12-16)27-15-26-19/h2-6,11-12H,7-10,13-15H2,1H3