methyl 3-[4-(4,5-diphenyl-1,3-oxazol-2-yl)butoxy]benzoate

Systemtic Name: methyl 3-[4-(4,5-diphenyl-1,3-oxazol-2-yl)butoxy]benzoate Openeye Name: methyl 3-[4-(4,5-diphenyloxazol-2-yl)butoxy]benzoate CAS Name: 3-[4-(4,5-diphenyl-2-oxazolyl)butoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[4-(4,5-diphenyl-1,3-oxazol-2-yl)butoxy]benzoate Traditional Name: 3-[4-(4,5-diphenyloxazol-2-yl)butoxy]benzoic acid methyl ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCCCCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCCCCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO4/c1-30-27(29)22-15-10-16-23(19-22)31-18-9-8-17-24-28-25(20-11-4-2-5-12-20)26(32-24)21-13-6-3-7-14-21/h2-7,10-16,19H,8-9,17-18H2,1H3