4-[[4-methoxy-3-(2-methylundecan-2-yl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[4-methoxy-3-(2-methylundecan-2-yl)phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[3-(1,1-dimethyldecyl)-4-methoxy-benzoyl]amino]benzoic acid CAS Name: 4-[[[4-methoxy-3-(2-methylundecan-2-yl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-methoxy-3-(2-methylundecan-2-yl)benzoyl]amino]benzoic acid Traditional Name: 4-[[3-(1,1-dimethyldecyl)-4-methoxy-benzoyl]amino]benzoic acid Formula: C27H37NO4 MolecularWeight: 439.58698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCCCCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C27H37NO4/c1-5-6-7-8-9-10-11-18-27(2,3)23-19-21(14-17-24(23)32-4)25(29)28-22-15-12-20(13-16-22)26(30)31/h12-17,19H,5-11,18H2,1-4H3,(H,28,29)(H,30,31)