1-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-8-(3-methyl-1,2-oxazol-5-yl)octan-1-one

Systemtic Name: 1-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-8-(3-methyl-1,2-oxazol-5-yl)octan-1-one Openeye Name: 1-[4-(4,5-dihydrooxazol-2-yl)phenyl]-8-(3-methylisoxazol-5-yl)octan-1-one CAS Name: 1-[4-(4,5-dihydrooxazol-2-yl)phenyl]-8-(3-methyl-5-isoxazolyl)-1-octanone IUPAC Name: 1-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-8-(3-methyl-1,2-oxazol-5-yl)octan-1-one Traditional Name: 8-(3-methylisoxazol-5-yl)-1-[4-(2-oxazolin-2-yl)phenyl]octan-1-one Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCCCC(=O)C2=CC=C(C=C2)C3=NCCO3

Isomeric SMILES

CC1=NOC(=C1)CCCCCCCC(=O)C2=CC=C(C=C2)C3=NCCO3

InChI

InChI=1S/C21H26N2O3/c1-16-15-19(26-23-16)7-5-3-2-4-6-8-20(24)17-9-11-18(12-10-17)21-22-13-14-25-21/h9-12,15H,2-8,13-14H2,1H3