5-(5-methoxy-4-propanoyl-2-prop-2-enyl-phenoxy)pentanenitrile

Systemtic Name: 5-(5-methoxy-4-propanoyl-2-prop-2-enyl-phenoxy)pentanenitrile Openeye Name: 5-(2-allyl-5-methoxy-4-propanoyl-phenoxy)pentanenitrile CAS Name: 5-[5-methoxy-4-(1-oxopropyl)-2-prop-2-enylphenoxy]pentanenitrile IUPAC Name: 5-(5-methoxy-4-propanoyl-2-prop-2-enylphenoxy)pentanenitrile Traditional Name: 5-(2-allyl-5-methoxy-4-propionyl-phenoxy)valeronitrile Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1OC)OCCCCC#N)CC=C

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1OC)OCCCCC#N)CC=C

InChI

InChI=1S/C18H23NO3/c1-4-9-14-12-15(16(20)5-2)18(21-3)13-17(14)22-11-8-6-7-10-19/h4,12-13H,1,5-9,11H2,2-3H3