5-(2-methanoyl-3-oxidanyl-phenoxy)pentanenitrile

Systemtic Name: 5-(2-methanoyl-3-oxidanyl-phenoxy)pentanenitrile Openeye Name: 5-(2-formyl-3-hydroxy-phenoxy)pentanenitrile CAS Name: 5-(2-formyl-3-hydroxyphenoxy)pentanenitrile IUPAC Name: 5-(2-formyl-3-hydroxyphenoxy)pentanenitrile Traditional Name: 5-(2-formyl-3-hydroxy-phenoxy)valeronitrile Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c13-7-2-1-3-8-16-12-6-4-5-11(15)10(12)9-14/h4-6,9,15H,1-3,8H2