3-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propanoic acid

Systemtic Name: 3-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propanoic acid Openeye Name: 3-[5-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propanoic acid CAS Name: 3-[5-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propanoic acid IUPAC Name: 3-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propanoic acid Traditional Name: 3-[5-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]-2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-8-yl]propionic acid Formula: C27H32N2O6S MolecularWeight: 512.61778

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC2=C(C=CC(=C2C1)CCC(=O)O)OCCC3=C(OC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CCCS(=O)(=O)N1CCC2=C(C=CC(=C2C1)CCC(=O)O)OCCC3=C(OC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H32N2O6S/c1-3-17-36(32,33)29-15-13-22-23(18-29)20(10-12-26(30)31)9-11-25(22)34-16-14-24-19(2)35-27(28-24)21-7-5-4-6-8-21/h4-9,11H,3,10,12-18H2,1-2H3,(H,30,31)