2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one Openeye Name: 2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one CAS Name: 2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one IUPAC Name: 2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-1H-pyrazol-3-one Traditional Name: 2-(1,3-benzoxazol-2-yl)-5-methyl-4-phenethyl-3-pyrazolin-3-one Formula: C19H17N3O2 MolecularWeight: 319.35718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3O2)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3O2)CCC4=CC=CC=C4

InChI

InChI=1S/C19H17N3O2/c1-13-15(12-11-14-7-3-2-4-8-14)18(23)22(21-13)19-20-16-9-5-6-10-17(16)24-19/h2-10,21H,11-12H2,1H3