(E)-2-(benzotriazol-1-yl)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(benzotriazol-1-yl)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(benzotriazol-1-yl)-3-(2-chloro-6-methoxy-3-quinolyl)prop-2-enenitrile CAS Name: (E)-2-(1-benzotriazolyl)-3-(2-chloro-6-methoxy-3-quinolinyl)-2-propenenitrile IUPAC Name: (E)-2-(benzotriazol-1-yl)-3-(2-chloro-6-methoxyquinolin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(benzotriazol-1-yl)-3-(2-chloro-6-methoxy-3-quinolyl)acrylonitrile Formula: C19H12ClN5O MolecularWeight: 361.78448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(N=C2C=C1)Cl)C=C(C#N)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC2=CC(=C(N=C2C=C1)Cl)/C=C(\C#N)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H12ClN5O/c1-26-15-6-7-16-12(10-15)8-13(19(20)22-16)9-14(11-21)25-18-5-3-2-4-17(18)23-24-25/h2-10H,1H3/b14-9+