tert-butyl 2-[(2,3-dimethyl-1-benzofuran-7-yl)-oxidanyl-methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(2,3-dimethyl-1-benzofuran-7-yl)-oxidanyl-methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[(2,3-dimethylbenzofuran-7-yl)-hydroxy-methyl]piperidine-1-carboxylate CAS Name: 2-[(2,3-dimethyl-7-benzofuranyl)-hydroxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2,3-dimethyl-1-benzofuran-7-yl)-hydroxymethyl]piperidine-1-carboxylate Traditional Name: 2-[(2,3-dimethylbenzofuran-7-yl)-hydroxy-methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2C(C3CCCCN3C(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2C(C3CCCCN3C(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C21H29NO4/c1-13-14(2)25-19-15(13)9-8-10-16(19)18(23)17-11-6-7-12-22(17)20(24)26-21(3,4)5/h8-10,17-18,23H,6-7,11-12H2,1-5H3