methyl 2-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(2-hydroxy-5-isopropyl-4-methyl-benzyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)CN2CC3=CC=CC=C3CC2C(=O)OC)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)CN2CC3=CC=CC=C3CC2C(=O)OC)O

InChI

InChI=1S/C22H27NO3/c1-14(2)19-10-18(21(24)9-15(19)3)13-23-12-17-8-6-5-7-16(17)11-20(23)22(25)26-4/h5-10,14,20,24H,11-13H2,1-4H3