4,4-dimethyl-2-(4-pyren-1-ylphenyl)-5H-1,3-oxazole

Systemtic Name: 4,4-dimethyl-2-(4-pyren-1-ylphenyl)-5H-1,3-oxazole Openeye Name: 4,4-dimethyl-2-(4-pyren-1-ylphenyl)-5H-oxazole CAS Name: 4,4-dimethyl-2-[4-(1-pyrenyl)phenyl]-5H-oxazole IUPAC Name: 4,4-dimethyl-2-(4-pyren-1-ylphenyl)-5H-1,3-oxazole Traditional Name: 4,4-dimethyl-2-(4-pyren-1-ylphenyl)-2-oxazoline Formula: C27H21NO MolecularWeight: 375.46174

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=N1)C2=CC=C(C=C2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3)C

Isomeric SMILES

CC1(COC(=N1)C2=CC=C(C=C2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3)C

InChI

InChI=1S/C27H21NO/c1-27(2)16-29-26(28-27)21-10-6-17(7-11-21)22-14-12-20-9-8-18-4-3-5-19-13-15-23(22)25(20)24(18)19/h3-15H,16H2,1-2H3