sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]phenoxy]propanoate

Systemtic Name: sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]phenoxy]propanoate Openeye Name: sodium 2-[3-[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]phenoxy]propanoate CAS Name: sodium 2-[3-[2-(4,5-diphenyl-2-oxazolyl)-1-cyclohex-2-enyl]phenoxy]propanoate IUPAC Name: sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]phenoxy]propanoate Traditional Name: sodium 2-[3-[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]phenoxy]propionate Formula: C30H26NNaO4 MolecularWeight: 487.52151

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])OC1=CC=CC(=C1)C2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5.[Na+]

Isomeric SMILES

CC(C(=O)[O-])OC1=CC=CC(=C1)C2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5.[Na+]

InChI

InChI=1S/C30H27NO4.Na/c1-20(30(32)33)34-24-16-10-15-23(19-24)25-17-8-9-18-26(25)29-31-27(21-11-4-2-5-12-21)28(35-29)22-13-6-3-7-14-22;/h2-7,10-16,18-20,25H,8-9,17H2,1H3,(H,32,33);/q;+1/p-1