4-(4-methanoyl-2-methoxy-phenoxy)butanenitrile

Systemtic Name: 4-(4-methanoyl-2-methoxy-phenoxy)butanenitrile Openeye Name: 4-(4-formyl-2-methoxy-phenoxy)butanenitrile CAS Name: 4-(4-formyl-2-methoxyphenoxy)butanenitrile IUPAC Name: 4-(4-formyl-2-methoxyphenoxy)butanenitrile Traditional Name: 4-(4-formyl-2-methoxy-phenoxy)butyronitrile Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OCCCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCCCC#N

InChI

InChI=1S/C12H13NO3/c1-15-12-8-10(9-14)4-5-11(12)16-7-3-2-6-13/h4-5,8-9H,2-3,7H2,1H3