methyl 7-oxidanyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 7-oxidanyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-benzyl-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 7-hydroxy-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-benzyl-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=C(CN1CC3=CC=CC=C3)C=C(C=C2)O

Isomeric SMILES

COC(=O)C1CC2=C(CN1CC3=CC=CC=C3)C=C(C=C2)O

InChI

InChI=1S/C18H19NO3/c1-22-18(21)17-10-14-7-8-16(20)9-15(14)12-19(17)11-13-5-3-2-4-6-13/h2-9,17,20H,10-12H2,1H3