tert-butyl 4-(hydroxymethyl)-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 4-(hydroxymethyl)-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 4-(hydroxymethyl)-1H-isoquinoline-2-carboxylate CAS Name: 4-(hydroxymethyl)-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(hydroxymethyl)-1H-isoquinoline-2-carboxylate Traditional Name: 4-methylol-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=CC=CC=C2C(=C1)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=CC=CC=C2C(=C1)CO

InChI

InChI=1S/C15H19NO3/c1-15(2,3)19-14(18)16-8-11-6-4-5-7-13(11)12(9-16)10-17/h4-7,9,17H,8,10H2,1-3H3