N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[(2-methylphenyl)methylamino]piperidin-1-yl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[(2-methylphenyl)methylamino]piperidin-1-yl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(o-tolylmethylamino)-1-piperidyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[(2-methylphenyl)methylamino]-1-piperidinyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-[(2-methylphenyl)methylamino]piperidin-1-yl]benzamide Traditional Name: 4-[4-[(2-methylbenzyl)amino]piperidino]-N-piperonyl-benzamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1CNC2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H31N3O3/c1-20-4-2-3-5-23(20)18-29-24-12-14-31(15-13-24)25-9-7-22(8-10-25)28(32)30-17-21-6-11-26-27(16-21)34-19-33-26/h2-11,16,24,29H,12-15,17-19H2,1H3,(H,30,32)