methyl 1-(1-phenylethyl)piperidine-2-carboxylate; 2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: methyl 1-(1-phenylethyl)piperidine-2-carboxylate; 2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: 2-hydroxy-2-phenyl-acetic acid; methyl 1-(1-phenylethyl)piperidine-2-carboxylate CAS Name: 2-hydroxy-2-phenylacetic acid; 1-(1-phenylethyl)-2-piperidinecarboxylic acid methyl ester IUPAC Name: 2-hydroxy-2-phenylacetic acid; methyl 1-(1-phenylethyl)piperidine-2-carboxylate Traditional Name: madelic acid; 1-(1-phenylethyl)pipecolinic acid methyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCCCC2C(=O)OC.C1=CC=C(C=C1)C(C(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCCCC2C(=O)OC.C1=CC=C(C=C1)C(C(=O)O)O

InChI

InChI=1S/C15H21NO2.C8H8O3/c1-12(13-8-4-3-5-9-13)16-11-7-6-10-14(16)15(17)18-2;9-7(8(10)11)6-4-2-1-3-5-6/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3;1-5,7,9H,(H,10,11)