sodium 3-[1-[3-[(7-chloranylquinolin-2-yl)methoxy]phenyl]-3-[2-(2-oxidanylpropan-2-yl)phenyl]propyl]sulfanyl-2-cyclopropyl-propanoate

Systemtic Name: sodium 3-[1-[3-[(7-chloranylquinolin-2-yl)methoxy]phenyl]-3-[2-(2-oxidanylpropan-2-yl)phenyl]propyl]sulfanyl-2-cyclopropyl-propanoate Openeye Name: sodium 3-[1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl]sulfanyl-2-cyclopropyl-propanoate CAS Name: sodium 3-[[1-[3-[(7-chloro-2-quinolinyl)methoxy]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]thio]-2-cyclopropylpropanoate IUPAC Name: sodium 3-[1-[3-[(7-chloroquinolin-2-yl)methoxy]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanyl-2-cyclopropylpropanoate Traditional Name: sodium 3-[[1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl]thio]-2-cyclopropyl-propionate Formula: C34H35ClNNaO4S MolecularWeight: 612.15377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1CCC(C2=CC(=CC=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)SCC(C5CC5)C(=O)[O-])O.[Na+]

Isomeric SMILES

CC(C)(C1=CC=CC=C1CCC(C2=CC(=CC=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)SCC(C5CC5)C(=O)[O-])O.[Na+]

InChI

InChI=1S/C34H36ClNO4S.Na/c1-34(2,39)30-9-4-3-6-23(30)14-17-32(41-21-29(33(37)38)22-10-11-22)25-7-5-8-28(18-25)40-20-27-16-13-24-12-15-26(35)19-31(24)36-27;/h3-9,12-13,15-16,18-19,22,29,32,39H,10-11,14,17,20-21H2,1-2H3,(H,37,38);/q;+1/p-1