(2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2S)-2-[methyl(piperonyl)amino]-2-phenyl-1-piperidino-ethanone Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)[C@@H](C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C22H26N2O3/c1-23(15-17-10-11-19-20(14-17)27-16-26-19)21(18-8-4-2-5-9-18)22(25)24-12-6-3-7-13-24/h2,4-5,8-11,14,21H,3,6-7,12-13,15-16H2,1H3/t21-/m0/s1