4-[[4-[(4-butan-2-ylphenyl)iminomethyl]-2-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(4-butan-2-ylphenyl)iminomethyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-methoxy-4-[(4-sec-butylphenyl)iminomethyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(4-butan-2-ylphenyl)iminomethyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(4-butan-2-ylphenyl)iminomethyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-methoxy-4-[(4-sec-butylphenyl)iminomethyl]phenoxy]methyl]benzoic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C26H27NO4/c1-4-18(2)21-10-12-23(13-11-21)27-16-20-7-14-24(25(15-20)30-3)31-17-19-5-8-22(9-6-19)26(28)29/h5-16,18H,4,17H2,1-3H3,(H,28,29)