4-[4-[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl]phenyl]benzoic acid

Systemtic Name: 4-[4-[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl]phenyl]benzoic acid Openeye Name: 4-[4-[2-(diisopropylamino)-2-oxo-ethyl]phenyl]benzoic acid CAS Name: 4-[4-[2-[di(propan-2-yl)amino]-2-oxoethyl]phenyl]benzoic acid IUPAC Name: 4-[4-[2-[di(propan-2-yl)amino]-2-oxoethyl]phenyl]benzoic acid Traditional Name: 4-[4-[2-(diisopropylamino)-2-keto-ethyl]phenyl]benzoic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)N(C(C)C)C(=O)CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C21H25NO3/c1-14(2)22(15(3)4)20(23)13-16-5-7-17(8-6-16)18-9-11-19(12-10-18)21(24)25/h5-12,14-15H,13H2,1-4H3,(H,24,25)