3-[3-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propoxy]benzenecarbonitrile Openeye Name: 3-[3-(2-hydroxy-4-oxo-chromen-3-yl)propoxy]benzonitrile CAS Name: 3-[3-(2-hydroxy-4-oxo-1-benzopyran-3-yl)propoxy]benzonitrile IUPAC Name: 3-[3-(2-hydroxy-4-oxochromen-3-yl)propoxy]benzonitrile Traditional Name: 3-[3-(2-hydroxy-4-keto-chromen-3-yl)propoxy]benzonitrile Formula: C19H15NO4 MolecularWeight: 321.3267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)CCCOC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)CCCOC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H15NO4/c20-12-13-5-3-6-14(11-13)23-10-4-8-16-18(21)15-7-1-2-9-17(15)24-19(16)22/h1-3,5-7,9,11,22H,4,8,10H2