2-[3-[(E)-3-(4-methoxy-2-oxidanylidene-chromen-3-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(E)-3-(4-methoxy-2-oxidanylidene-chromen-3-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[3-[(E)-3-(4-methoxy-2-oxo-chromen-3-yl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[3-[(E)-3-(4-methoxy-2-oxo-1-benzopyran-3-yl)-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[3-[(E)-3-(4-methoxy-2-oxochromen-3-yl)-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[3-[(E)-3-keto-3-(2-keto-4-methoxy-chromen-3-yl)prop-1-enyl]phenoxy]acetonitrile Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)OC2=CC=CC=C21)C(=O)C=CC3=CC(=CC=C3)OCC#N

Isomeric SMILES

COC1=C(C(=O)OC2=CC=CC=C21)C(=O)/C=C/C3=CC(=CC=C3)OCC#N

InChI

InChI=1S/C21H15NO5/c1-25-20-16-7-2-3-8-18(16)27-21(24)19(20)17(23)10-9-14-5-4-6-15(13-14)26-12-11-22/h2-10,13H,12H2,1H3/b10-9+