3,3-dimethyl-4-[1-(phenylmethyl)piperidin-4-yl]butanoate

Systemtic Name: 3,3-dimethyl-4-[1-(phenylmethyl)piperidin-4-yl]butanoate Openeye Name: 4-(1-benzyl-4-piperidyl)-3,3-dimethyl-butanoate CAS Name: 3,3-dimethyl-4-[1-(phenylmethyl)-4-piperidinyl]butanoate IUPAC Name: 4-(1-benzylpiperidin-4-yl)-3,3-dimethylbutanoate Traditional Name: 4-(1-benzyl-4-piperidyl)-3,3-dimethyl-butyrate Formula: C18H26NO2- MolecularWeight: 288.40454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1CCN(CC1)CC2=CC=CC=C2)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC1CCN(CC1)CC2=CC=CC=C2)CC(=O)[O-]

InChI

InChI=1S/C18H27NO2/c1-18(2,13-17(20)21)12-15-8-10-19(11-9-15)14-16-6-4-3-5-7-16/h3-7,15H,8-14H2,1-2H3,(H,20,21)/p-1