2-[2-[(3,4-dichlorophenyl)-methyl-amino]-1,3-benzoxazol-5-yl]propanenitrile

Systemtic Name: 2-[2-[(3,4-dichlorophenyl)-methyl-amino]-1,3-benzoxazol-5-yl]propanenitrile Openeye Name: 2-[2-(3,4-dichloro-N-methyl-anilino)-1,3-benzoxazol-5-yl]propanenitrile CAS Name: 2-[2-(3,4-dichloro-N-methylanilino)-1,3-benzoxazol-5-yl]propanenitrile IUPAC Name: 2-[2-(3,4-dichloro-N-methylanilino)-1,3-benzoxazol-5-yl]propanenitrile Traditional Name: 2-[2-(3,4-dichloro-N-methyl-anilino)-1,3-benzoxazol-5-yl]propionitrile Formula: C17H13Cl2N3O MolecularWeight: 346.21062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC2=C(C=C1)OC(=N2)N(C)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C#N)C1=CC2=C(C=C1)OC(=N2)N(C)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2N3O/c1-10(9-20)11-3-6-16-15(7-11)21-17(23-16)22(2)12-4-5-13(18)14(19)8-12/h3-8,10H,1-2H3