5-[(1S)-1-(benzotriazol-1-yl)but-3-enyl]-3-(4-methylphenyl)-1,2-oxazole

Systemtic Name: 5-[(1S)-1-(benzotriazol-1-yl)but-3-enyl]-3-(4-methylphenyl)-1,2-oxazole Openeye Name: 5-[(1S)-1-(benzotriazol-1-yl)but-3-enyl]-3-(p-tolyl)isoxazole CAS Name: 5-[(1S)-1-(1-benzotriazolyl)but-3-enyl]-3-(4-methylphenyl)isoxazole IUPAC Name: 5-[(1S)-1-(benzotriazol-1-yl)but-3-enyl]-3-(4-methylphenyl)-1,2-oxazole Traditional Name: 5-[(1S)-1-(benzotriazol-1-yl)but-3-enyl]-3-(p-tolyl)isoxazole Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)C(CC=C)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)[C@H](CC=C)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H18N4O/c1-3-6-19(24-18-8-5-4-7-16(18)21-23-24)20-13-17(22-25-20)15-11-9-14(2)10-12-15/h3-5,7-13,19H,1,6H2,2H3/t19-/m0/s1