(3S)-7-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-pyridin-2-ylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3S)-7-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-pyridin-2-ylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3S)-7-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-(pyridine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3S)-7-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-2-[oxo(2-pyridinyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3S)-7-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-(pyridine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3S)-7-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-picolinoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C28H25N3O5 MolecularWeight: 483.5152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC4=C(CC(N(C4)C(=O)C5=CC=CC=N5)C(=O)O)C=C3

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC4=C(C[C@H](N(C4)C(=O)C5=CC=CC=N5)C(=O)O)C=C3

InChI

InChI=1S/C28H25N3O5/c1-18-23(30-26(36-18)19-7-3-2-4-8-19)12-14-35-22-11-10-20-16-25(28(33)34)31(17-21(20)15-22)27(32)24-9-5-6-13-29-24/h2-11,13,15,25H,12,14,16-17H2,1H3,(H,33,34)/t25-/m0/s1