(phenylmethyl) 8-methyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (phenylmethyl) 8-methyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: benzyl 1-(2-tert-butoxy-2-oxo-ethyl)-8-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 8-methyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 8-methyl-1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-tert-butoxy-2-keto-ethyl)-8-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(N(CC2)C(=O)OCC3=CC=CC=C3)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1C(N(CC2)C(=O)OCC3=CC=CC=C3)CC(=O)OC(C)(C)C

InChI

InChI=1S/C24H29NO4/c1-17-9-8-12-19-13-14-25(23(27)28-16-18-10-6-5-7-11-18)20(22(17)19)15-21(26)29-24(2,3)4/h5-12,20H,13-16H2,1-4H3