2-(phenylcarbonyl)-1-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(phenylcarbonyl)-1-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-benzoyl-1-[2-(2-phenyloxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-benzoyl-1-[2-(2-phenyl-4-oxazolyl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-benzoyl-1-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-benzoyl-1-[2-(2-phenyloxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C28H24N2O5 MolecularWeight: 468.50056

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(C2=CC=CC=C21)OCCC3=COC(=N3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C(N(C(C2=CC=CC=C21)OCCC3=COC(=N3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C28H24N2O5/c31-26(20-11-5-2-6-12-20)30-24(28(32)33)17-21-13-7-8-14-23(21)27(30)34-16-15-22-18-35-25(29-22)19-9-3-1-4-10-19/h1-14,18,24,27H,15-17H2,(H,32,33)