2-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]benzenecarbonitrile

Systemtic Name: 2-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]benzenecarbonitrile Openeye Name: 2-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl]oxymethyl]benzonitrile CAS Name: 2-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl]oxymethyl]benzonitrile IUPAC Name: 2-[[2-(4-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl]oxymethyl]benzonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl]oxymethyl]benzonitrile Formula: C25H18ClNO3 MolecularWeight: 415.86832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4C#N)C

InChI

InChI=1S/C25H18ClNO3/c1-15-11-21-22(12-16(15)2)30-24(17-7-9-20(26)10-8-17)25(23(21)28)29-14-19-6-4-3-5-18(19)13-27/h3-12H,14H2,1-2H3