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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3CC4=CC=CC=C4C(N3CC5=CC=NC=C5)C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3CC4=CC=CC=C4C(N3CC5=CC=NC=C5)C(=O)O

InChI

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