ethyl 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylate

Systemtic Name: ethyl 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylate Openeye Name: ethyl 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylate CAS Name: 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylate Traditional Name: 5-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-1,3,4-oxadiazole-2-carboxylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN=C(O1)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC(=O)C1=NN=C(O1)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

InChI

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