2-(2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]-1-[1-(pyrazin-2-ylmethyl)piperidin-4-yl]ethanone

Systemtic Name: 2-(2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]-1-[1-(pyrazin-2-ylmethyl)piperidin-4-yl]ethanone Openeye Name: 2-tert-butoxy-2-(o-tolyl)-1-[1-(pyrazin-2-ylmethyl)-4-piperidyl]ethanone CAS Name: 2-(2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]-1-[1-(2-pyrazinylmethyl)-4-piperidinyl]ethanone IUPAC Name: 2-(2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]-1-[1-(pyrazin-2-ylmethyl)piperidin-4-yl]ethanone Traditional Name: 2-tert-butoxy-2-(o-tolyl)-1-[1-(pyrazin-2-ylmethyl)-4-piperidyl]ethanone Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(=O)C2CCN(CC2)CC3=NC=CN=C3)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C(C(=O)C2CCN(CC2)CC3=NC=CN=C3)OC(C)(C)C

InChI

InChI=1S/C23H31N3O2/c1-17-7-5-6-8-20(17)22(28-23(2,3)4)21(27)18-9-13-26(14-10-18)16-19-15-24-11-12-25-19/h5-8,11-12,15,18,22H,9-10,13-14,16H2,1-4H3