3-[5-[[(4-propan-2-ylphenyl)amino]methyl]-1,3-benzoxazol-2-yl]benzoic acid

Systemtic Name: 3-[5-[[(4-propan-2-ylphenyl)amino]methyl]-1,3-benzoxazol-2-yl]benzoic acid Openeye Name: 3-[5-[(4-isopropylanilino)methyl]-1,3-benzoxazol-2-yl]benzoic acid CAS Name: 3-[5-[(4-propan-2-ylanilino)methyl]-1,3-benzoxazol-2-yl]benzoic acid IUPAC Name: 3-[5-[(4-propan-2-ylanilino)methyl]-1,3-benzoxazol-2-yl]benzoic acid Traditional Name: 3-[5-(cumidinomethyl)-1,3-benzoxazol-2-yl]benzoic acid Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C24H22N2O3/c1-15(2)17-7-9-20(10-8-17)25-14-16-6-11-22-21(12-16)26-23(29-22)18-4-3-5-19(13-18)24(27)28/h3-13,15,25H,14H2,1-2H3,(H,27,28)