(2S)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(methylcarbamoyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(methylcarbamoyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(methylcarbamoyl)-2-phenyl-acetamide CAS Name: (2S)-2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(methylcarbamoyl)-2-phenylacetamide IUPAC Name: (2S)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(methylcarbamoyl)-2-phenylacetamide Traditional Name: (2S)-N-(methylcarbamoyl)-2-phenyl-2-(4-piperonylpiperazino)acetamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N4O4/c1-23-22(28)24-21(27)20(17-5-3-2-4-6-17)26-11-9-25(10-12-26)14-16-7-8-18-19(13-16)30-15-29-18/h2-8,13,20H,9-12,14-15H2,1H3,(H2,23,24,27,28)/t20-/m0/s1