2-[4-(diphenylmethyl)piperazin-1-yl]-N-(6-methyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-N-(6-methyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-N-(6-methyl-1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-N-(6-methyl-1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-N-(6-methyl-1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-(4-benzhydrylpiperazino)-N-(6-methyl-1,3-benzodioxol-5-yl)acetamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OCO2

InChI

InChI=1S/C27H29N3O3/c1-20-16-24-25(33-19-32-24)17-23(20)28-26(31)18-29-12-14-30(15-13-29)27(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-11,16-17,27H,12-15,18-19H2,1H3,(H,28,31)