4-[[[6-(2-methylphenyl)-1,2-benzoxazol-3-yl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[6-(2-methylphenyl)-1,2-benzoxazol-3-yl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[6-(o-tolyl)-1,2-benzoxazol-3-yl]amino]methyl]benzonitrile CAS Name: 4-[[[6-(2-methylphenyl)-1,2-benzoxazol-3-yl]amino]methyl]benzonitrile IUPAC Name: 4-[[[6-(2-methylphenyl)-1,2-benzoxazol-3-yl]amino]methyl]benzonitrile Traditional Name: 4-[[[6-(o-tolyl)indoxazen-3-yl]amino]methyl]benzonitrile Formula: C22H17N3O MolecularWeight: 339.38988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C=C2)C(=NO3)NCC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C=C2)C(=NO3)NCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H17N3O/c1-15-4-2-3-5-19(15)18-10-11-20-21(12-18)26-25-22(20)24-14-17-8-6-16(13-23)7-9-17/h2-12H,14H2,1H3,(H,24,25)