4-(4-cyanobutoxy)-3-methoxy-benzoic acid

Systemtic Name: 4-(4-cyanobutoxy)-3-methoxy-benzoic acid Openeye Name: 4-(4-cyanobutoxy)-3-methoxy-benzoic acid CAS Name: 4-(4-cyanobutoxy)-3-methoxybenzoic acid IUPAC Name: 4-(4-cyanobutoxy)-3-methoxybenzoic acid Traditional Name: 4-(4-cyanobutoxy)-3-methoxy-benzoic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO4/c1-17-12-9-10(13(15)16)5-6-11(12)18-8-4-2-3-7-14/h5-6,9H,2-4,8H2,1H3,(H,15,16)