3-(4-azanylphenoxy)-5-[4-(dodecylamino)phenoxy]benzoic acid

Systemtic Name: 3-(4-azanylphenoxy)-5-[4-(dodecylamino)phenoxy]benzoic acid Openeye Name: 3-(4-aminophenoxy)-5-[4-(dodecylamino)phenoxy]benzoic acid CAS Name: 3-(4-aminophenoxy)-5-[4-(dodecylamino)phenoxy]benzoic acid IUPAC Name: 3-(4-aminophenoxy)-5-[4-(dodecylamino)phenoxy]benzoic acid Traditional Name: 3-(4-aminophenoxy)-5-[4-(laurylamino)phenoxy]benzoic acid Formula: C31H40N2O4 MolecularWeight: 504.6603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=CC=C(C=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCNC1=CC=C(C=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)N)C(=O)O

InChI

InChI=1S/C31H40N2O4/c1-2-3-4-5-6-7-8-9-10-11-20-33-26-14-18-28(19-15-26)37-30-22-24(31(34)35)21-29(23-30)36-27-16-12-25(32)13-17-27/h12-19,21-23,33H,2-11,20,32H2,1H3,(H,34,35)