N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(diphenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(diphenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[4-(diphenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide Traditional Name: 2-(4-benzhydrylpiperazino)-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O4/c32-25(29-27(33)28-22-11-12-23-24(17-22)35-19-34-23)18-30-13-15-31(16-14-30)26(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17,26H,13-16,18-19H2,(H2,28,29,32,33)