(E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-phenylmethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-phenylmethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-3-(3-benzyloxyphenyl)-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-(3-phenylmethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-(3-phenylmethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-3-(3-benzoxyphenyl)-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C24H17N3O2 MolecularWeight: 379.41068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C=C(C#N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=C(\C#N)/C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H17N3O2/c25-15-19(23-26-22-12-5-4-11-21(22)24(28)27-23)13-18-9-6-10-20(14-18)29-16-17-7-2-1-3-8-17/h1-14H,16H2,(H,26,27,28)/b19-13+