methyl 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate

Systemtic Name: methyl 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate Openeye Name: methyl 2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate CAS Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate Traditional Name: 2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)CN3CCC4=C(C3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)CN3CCC4=C(C3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H21N3O3/c1-14-3-5-16(6-4-14)20-23-22-19(27-20)13-24-10-9-15-7-8-17(21(25)26-2)11-18(15)12-24/h3-8,11H,9-10,12-13H2,1-2H3