(phenylmethyl) 6-azanyl-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (phenylmethyl) 6-azanyl-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 6-amino-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylate CAS Name: 6-amino-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-amino-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-amino-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC2(C1=CCN(C2)C(=O)OCC3=CC=CC=C3)C)N)C

Isomeric SMILES

CC1(C(CCC2(C1=CCN(C2)C(=O)OCC3=CC=CC=C3)C)N)C

InChI

InChI=1S/C20H28N2O2/c1-19(2)16-10-12-22(14-20(16,3)11-9-17(19)21)18(23)24-13-15-7-5-4-6-8-15/h4-8,10,17H,9,11-14,21H2,1-3H3