(E)-3-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-3,1-benzoxazin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-3,1-benzoxazin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-oxo-3,1-benzoxazin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-oxo-3,1-benzoxazin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-oxo-3,1-benzoxazin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-keto-3,1-benzoxazin-2-yl)acrylonitrile Formula: C19H14N2O4 MolecularWeight: 334.32546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3C(=O)O2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3C(=O)O2)OC

InChI

InChI=1S/C19H14N2O4/c1-23-16-8-7-12(10-17(16)24-2)9-13(11-20)18-21-15-6-4-3-5-14(15)19(22)25-18/h3-10H,1-2H3/b13-9+