4-azanyl-3-(4-methoxy-4-oxidanylidene-butoxy)benzoic acid

Systemtic Name: 4-azanyl-3-(4-methoxy-4-oxidanylidene-butoxy)benzoic acid Openeye Name: 4-amino-3-(4-methoxy-4-oxo-butoxy)benzoic acid CAS Name: 4-amino-3-(4-methoxy-4-oxobutoxy)benzoic acid IUPAC Name: 4-amino-3-(4-methoxy-4-oxobutoxy)benzoic acid Traditional Name: 4-amino-3-(4-keto-4-methoxy-butoxy)benzoic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=C(C=CC(=C1)C(=O)O)N

Isomeric SMILES

COC(=O)CCCOC1=C(C=CC(=C1)C(=O)O)N

InChI

InChI=1S/C12H15NO5/c1-17-11(14)3-2-6-18-10-7-8(12(15)16)4-5-9(10)13/h4-5,7H,2-3,6,13H2,1H3,(H,15,16)