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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O3/c31-26(28-18-21-11-12-24-25(17-21)33-20-32-24)19-29-13-15-30(16-14-29)27(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-12,17,27H,13-16,18-20H2,(H,28,31)