4-[(2,5-dimethoxyphenyl)methylamino]butanoic acid

Systemtic Name: 4-[(2,5-dimethoxyphenyl)methylamino]butanoic acid Openeye Name: 4-[(2,5-dimethoxyphenyl)methylamino]butanoic acid CAS Name: 4-[(2,5-dimethoxyphenyl)methylamino]butanoic acid IUPAC Name: 4-[(2,5-dimethoxyphenyl)methylamino]butanoic acid Traditional Name: 4-[(2,5-dimethoxybenzyl)amino]butyric acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNCCCC(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNCCCC(=O)O

InChI

InChI=1S/C13H19NO4/c1-17-11-5-6-12(18-2)10(8-11)9-14-7-3-4-13(15)16/h5-6,8,14H,3-4,7,9H2,1-2H3,(H,15,16)