3-(hexoxycarbonylamino)-2-oxidanyl-5-(2-phenylpropan-2-yl)benzoic acid

Systemtic Name: 3-(hexoxycarbonylamino)-2-oxidanyl-5-(2-phenylpropan-2-yl)benzoic acid Openeye Name: 3-(hexoxycarbonylamino)-2-hydroxy-5-(1-methyl-1-phenyl-ethyl)benzoic acid CAS Name: 3-[[hexoxy(oxo)methyl]amino]-2-hydroxy-5-(2-phenylpropan-2-yl)benzoic acid IUPAC Name: 3-(hexoxycarbonylamino)-2-hydroxy-5-(2-phenylpropan-2-yl)benzoic acid Traditional Name: 5-cumyl-3-(hexoxycarbonylamino)-2-hydroxy-benzoic acid Formula: C23H29NO5 MolecularWeight: 399.48006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC1=C(C(=CC(=C1)C(C)(C)C2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

CCCCCCOC(=O)NC1=C(C(=CC(=C1)C(C)(C)C2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C23H29NO5/c1-4-5-6-10-13-29-22(28)24-19-15-17(14-18(20(19)25)21(26)27)23(2,3)16-11-8-7-9-12-16/h7-9,11-12,14-15,25H,4-6,10,13H2,1-3H3,(H,24,28)(H,26,27)