4-[(4-methoxy-3-oxidanyl-phenyl)-[(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid

Systemtic Name: 4-[(4-methoxy-3-oxidanyl-phenyl)-[(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid Openeye Name: 4-[3-hydroxy-4-methoxy-N-[(3,4,5-trimethoxyphenyl)methyl]anilino]butanoic acid CAS Name: 4-[3-hydroxy-4-methoxy-N-[(3,4,5-trimethoxyphenyl)methyl]anilino]butanoic acid IUPAC Name: 4-[3-hydroxy-4-methoxy-N-[(3,4,5-trimethoxyphenyl)methyl]anilino]butanoic acid Traditional Name: 4-(3-hydroxy-4-methoxy-N-(3,4,5-trimethoxybenzyl)anilino)butyric acid Formula: C21H27NO7 MolecularWeight: 405.44158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCCC(=O)O)CC2=CC(=C(C(=C2)OC)OC)OC)O

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)O)CC2=CC(=C(C(=C2)OC)OC)OC)O

InChI

InChI=1S/C21H27NO7/c1-26-17-8-7-15(12-16(17)23)22(9-5-6-20(24)25)13-14-10-18(27-2)21(29-4)19(11-14)28-3/h7-8,10-12,23H,5-6,9,13H2,1-4H3,(H,24,25)