2-acetyloxy-4-[(4-decoxyphenyl)methylamino]benzoic acid

Systemtic Name: 2-acetyloxy-4-[(4-decoxyphenyl)methylamino]benzoic acid Openeye Name: 2-acetoxy-4-[(4-decoxyphenyl)methylamino]benzoic acid CAS Name: 2-acetyloxy-4-[(4-decoxyphenyl)methylamino]benzoic acid IUPAC Name: 2-acetyloxy-4-[(4-decoxyphenyl)methylamino]benzoic acid Traditional Name: 2-acetoxy-4-[(4-decoxybenzyl)amino]benzoic acid Formula: C26H35NO5 MolecularWeight: 441.5598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)CNC2=CC(=C(C=C2)C(=O)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)CNC2=CC(=C(C=C2)C(=O)O)OC(=O)C

InChI

InChI=1S/C26H35NO5/c1-3-4-5-6-7-8-9-10-17-31-23-14-11-21(12-15-23)19-27-22-13-16-24(26(29)30)25(18-22)32-20(2)28/h11-16,18,27H,3-10,17,19H2,1-2H3,(H,29,30)