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

Systemtic Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-2-chloranyl-5-methoxy-phenyl]ethanamide Openeye Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-chloro-5-methoxy-phenyl]acetamide CAS Name: N-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-2-chloro-5-methoxyphenyl]acetamide IUPAC Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-chloro-5-methoxyphenyl]acetamide Traditional Name: N-[2-chloro-5-methoxy-4-(4-piperonylpiperazine-1-carbonyl)phenyl]acetamide Formula: C22H24ClN3O5 MolecularWeight: 445.89606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C22H24ClN3O5/c1-14(27)24-18-11-20(29-2)16(10-17(18)23)22(28)26-7-5-25(6-8-26)12-15-3-4-19-21(9-15)31-13-30-19/h3-4,9-11H,5-8,12-13H2,1-2H3,(H,24,27)