N-(1,3-benzodioxol-5-ylmethyl)-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]benzamide Traditional Name: 4-[[4-(2-methoxyphenyl)piperazino]methyl]-N-piperonyl-benzamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H29N3O4/c1-32-24-5-3-2-4-23(24)30-14-12-29(13-15-30)18-20-6-9-22(10-7-20)27(31)28-17-21-8-11-25-26(16-21)34-19-33-25/h2-11,16H,12-15,17-19H2,1H3,(H,28,31)