5-(2-butyl-4-oxidanylidene-8-propyl-chromen-7-yl)oxypentanenitrile

Systemtic Name: 5-(2-butyl-4-oxidanylidene-8-propyl-chromen-7-yl)oxypentanenitrile Openeye Name: 5-(2-butyl-4-oxo-8-propyl-chromen-7-yl)oxypentanenitrile CAS Name: 5-[(2-butyl-4-oxo-8-propyl-1-benzopyran-7-yl)oxy]pentanenitrile IUPAC Name: 5-(2-butyl-4-oxo-8-propylchromen-7-yl)oxypentanenitrile Traditional Name: 5-(2-butyl-4-keto-8-propyl-chromen-7-yl)oxyvaleronitrile Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)C2=C(O1)C(=C(C=C2)OCCCCC#N)CCC

Isomeric SMILES

CCCCC1=CC(=O)C2=C(O1)C(=C(C=C2)OCCCCC#N)CCC

InChI

InChI=1S/C21H27NO3/c1-3-5-10-16-15-19(23)17-11-12-20(24-14-8-6-7-13-22)18(9-4-2)21(17)25-16/h11-12,15H,3-10,14H2,1-2H3