5-(benzotriazol-1-yl)-2-ethoxy-6-oxidanylidene-4-phenyl-1H-pyridine-3-carbonitrile

Systemtic Name: 5-(benzotriazol-1-yl)-2-ethoxy-6-oxidanylidene-4-phenyl-1H-pyridine-3-carbonitrile Openeye Name: 5-(benzotriazol-1-yl)-2-ethoxy-6-oxo-4-phenyl-1H-pyridine-3-carbonitrile CAS Name: 5-(1-benzotriazolyl)-2-ethoxy-6-oxo-4-phenyl-1H-pyridine-3-carbonitrile IUPAC Name: 5-(benzotriazol-1-yl)-2-ethoxy-6-oxo-4-phenyl-1H-pyridine-3-carbonitrile Traditional Name: 5-(benzotriazol-1-yl)-2-ethoxy-6-keto-4-phenyl-1H-pyridine-3-carbonitrile Formula: C20H15N5O2 MolecularWeight: 357.3654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=O)N1)N2C3=CC=CC=C3N=N2)C4=CC=CC=C4)C#N

Isomeric SMILES

CCOC1=C(C(=C(C(=O)N1)N2C3=CC=CC=C3N=N2)C4=CC=CC=C4)C#N

InChI

InChI=1S/C20H15N5O2/c1-2-27-20-14(12-21)17(13-8-4-3-5-9-13)18(19(26)22-20)25-16-11-7-6-10-15(16)23-24-25/h3-11H,2H2,1H3,(H,22,26)