(phenylmethyl) (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Systemtic Name: (phenylmethyl) (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate Openeye Name: benzyl (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate CAS Name: (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate Traditional Name: (3S)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid benzyl ester Formula: C19H21NO2 MolecularWeight: 295.37554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CNC(CC2=C1)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2CN[C@@H](CC2=C1)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C19H21NO2/c1-13-8-16-10-18(20-11-17(16)9-14(13)2)19(21)22-12-15-6-4-3-5-7-15/h3-9,18,20H,10-12H2,1-2H3/t18-/m0/s1