3-(7-methoxy-2-oxidanylidene-chromen-4-yl)-2,2-diphenyl-propanenitrile

Systemtic Name: 3-(7-methoxy-2-oxidanylidene-chromen-4-yl)-2,2-diphenyl-propanenitrile Openeye Name: 3-(7-methoxy-2-oxo-chromen-4-yl)-2,2-diphenyl-propanenitrile CAS Name: 3-(7-methoxy-2-oxo-1-benzopyran-4-yl)-2,2-diphenylpropanenitrile IUPAC Name: 3-(7-methoxy-2-oxochromen-4-yl)-2,2-diphenylpropanenitrile Traditional Name: 3-(2-keto-7-methoxy-chromen-4-yl)-2,2-diphenyl-propionitrile Formula: C25H19NO3 MolecularWeight: 381.42326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H19NO3/c1-28-21-12-13-22-18(14-24(27)29-23(22)15-21)16-25(17-26,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15H,16H2,1H3