(E)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(2-methylphenyl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(2-methylphenyl)amino]prop-2-enenitrile Openeye Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methylanilino)prop-2-enenitrile CAS Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methylanilino)-2-propenenitrile IUPAC Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methylanilino)prop-2-enenitrile Traditional Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(o-toluidino)acrylonitrile Formula: C17H12ClN3O MolecularWeight: 309.74968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC=C(C#N)C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N/C=C(\C#N)/C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C17H12ClN3O/c1-11-4-2-3-5-14(11)20-10-12(9-19)17-21-15-8-13(18)6-7-16(15)22-17/h2-8,10,20H,1H3/b12-10+