2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-chloranyl-2,6-diethyl-phenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-chloranyl-2,6-diethyl-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-chloro-2,6-diethyl-phenyl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(3-chloro-2,6-diethylphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(3-chloro-2,6-diethylphenyl)acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(4-piperonylpiperazino)acetamide Formula: C24H30ClN3O3 MolecularWeight: 443.9663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H30ClN3O3/c1-3-18-6-7-20(25)19(4-2)24(18)26-23(29)15-28-11-9-27(10-12-28)14-17-5-8-21-22(13-17)31-16-30-21/h5-8,13H,3-4,9-12,14-16H2,1-2H3,(H,26,29)