3-(3-butoxy-4-methoxy-phenyl)-3-oxidanyl-propanenitrile

Systemtic Name: 3-(3-butoxy-4-methoxy-phenyl)-3-oxidanyl-propanenitrile Openeye Name: 3-(3-butoxy-4-methoxy-phenyl)-3-hydroxy-propanenitrile CAS Name: 3-(3-butoxy-4-methoxyphenyl)-3-hydroxypropanenitrile IUPAC Name: 3-(3-butoxy-4-methoxyphenyl)-3-hydroxypropanenitrile Traditional Name: 3-(3-butoxy-4-methoxy-phenyl)-3-hydroxy-propionitrile Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C(CC#N)O)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C(CC#N)O)OC

InChI

InChI=1S/C14H19NO3/c1-3-4-9-18-14-10-11(12(16)7-8-15)5-6-13(14)17-2/h5-6,10,12,16H,3-4,7,9H2,1-2H3