3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid

Systemtic Name: 3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Openeye Name: 3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-(2-pyridylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid CAS Name: 3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-2-(2-pyridinylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid IUPAC Name: 3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Traditional Name: 3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-(2-pyridylmethyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid Formula: C28H27N3O4 MolecularWeight: 469.53168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3CC4=CC=CC=C4C(N3CC5=CC=CC=N5)C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3CC4=CC=CC=C4C(N3CC5=CC=CC=N5)C(=O)O

InChI

InChI=1S/C28H27N3O4/c1-19-24(30-27(35-19)20-9-3-2-4-10-20)14-16-34-25-17-21-11-5-6-13-23(21)26(28(32)33)31(25)18-22-12-7-8-15-29-22/h2-13,15,25-26H,14,16-18H2,1H3,(H,32,33)