4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]ethenyl]-4-oxidanylidene-chromen-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]ethenyl]-4-oxidanylidene-chromen-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]vinyl]-4-oxo-chromen-3-yl]benzonitrile CAS Name: 4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-4-oxo-1-benzopyran-3-yl]benzonitrile IUPAC Name: 4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-4-oxochromen-3-yl]benzonitrile Traditional Name: 4-[2-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]vinyl]-4-keto-chromen-3-yl]benzonitrile Formula: C29H23NO4 MolecularWeight: 449.49722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2CC2)C=CC3=C(C(=O)C4=CC=CC=C4O3)C5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=CC=CC(=C1OCC2CC2)/C=C/C3=C(C(=O)C4=CC=CC=C4O3)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H23NO4/c1-32-26-8-4-5-22(29(26)33-18-20-9-10-20)15-16-25-27(21-13-11-19(17-30)12-14-21)28(31)23-6-2-3-7-24(23)34-25/h2-8,11-16,20H,9-10,18H2,1H3/b16-15+