4-[(3-methylphenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid

Systemtic Name: 4-[(3-methylphenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-(m-tolylmethyl)piperidine-4-carboxylic acid CAS Name: 4-[(3-methylphenyl)methyl]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 4-[(3-methylphenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-(3-methylbenzyl)isonipecotic acid Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2(CCN(CC2)C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CC2(CCN(CC2)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C19H27NO4/c1-14-6-5-7-15(12-14)13-19(16(21)22)8-10-20(11-9-19)17(23)24-18(2,3)4/h5-7,12H,8-11,13H2,1-4H3,(H,21,22)