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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-butoxyphenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-butoxyphenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(4-butoxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-butoxyphenyl)methanone Traditional Name: (4-butoxyphenyl)-(4-piperonylpiperazino)methanone Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H28N2O4/c1-2-3-14-27-20-7-5-19(6-8-20)23(26)25-12-10-24(11-13-25)16-18-4-9-21-22(15-18)29-17-28-21/h4-9,15H,2-3,10-14,16-17H2,1H3