4-[(3,4-dimethoxyphenyl)amino]butanoate

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]butanoate Openeye Name: 4-(3,4-dimethoxyanilino)butanoate CAS Name: 4-(3,4-dimethoxyanilino)butanoate IUPAC Name: 4-(3,4-dimethoxyanilino)butanoate Traditional Name: 4-(3,4-dimethoxyanilino)butyrate Formula: C12H16NO4- MolecularWeight: 238.25974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCCCC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NCCCC(=O)[O-])OC

InChI

InChI=1S/C12H17NO4/c1-16-10-6-5-9(8-11(10)17-2)13-7-3-4-12(14)15/h5-6,8,13H,3-4,7H2,1-2H3,(H,14,15)/p-1