5-[(4E)-4-hydroxyimino-2-(4-methoxyphenyl)chromen-7-yl]oxypentanenitrile

Systemtic Name: 5-[(4E)-4-hydroxyimino-2-(4-methoxyphenyl)chromen-7-yl]oxypentanenitrile Openeye Name: 5-[(4E)-4-hydroxyimino-2-(4-methoxyphenyl)chromen-7-yl]oxypentanenitrile CAS Name: 5-[[(4E)-4-hydroxyimino-2-(4-methoxyphenyl)-1-benzopyran-7-yl]oxy]pentanenitrile IUPAC Name: 5-[(4E)-4-hydroxyimino-2-(4-methoxyphenyl)chromen-7-yl]oxypentanenitrile Traditional Name: 5-[(4E)-4-hydroximino-2-(4-methoxyphenyl)chromen-7-yl]oxyvaleronitrile Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NO)C3=C(O2)C=C(C=C3)OCCCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C/C(=N\O)/C3=C(O2)C=C(C=C3)OCCCCC#N

InChI

InChI=1S/C21H20N2O4/c1-25-16-7-5-15(6-8-16)20-14-19(23-24)18-10-9-17(13-21(18)27-20)26-12-4-2-3-11-22/h5-10,13-14,24H,2-4,12H2,1H3/b23-19+