2-[(3,3-dimethyl-7-propan-2-yl-2H-1-benzofuran-5-yl)-propan-2-yl-amino]benzoic acid

Systemtic Name: 2-[(3,3-dimethyl-7-propan-2-yl-2H-1-benzofuran-5-yl)-propan-2-yl-amino]benzoic acid Openeye Name: 2-[isopropyl-(7-isopropyl-3,3-dimethyl-2H-benzofuran-5-yl)amino]benzoic acid CAS Name: 2-[(3,3-dimethyl-7-propan-2-yl-2H-benzofuran-5-yl)-propan-2-ylamino]benzoic acid IUPAC Name: 2-[(3,3-dimethyl-7-propan-2-yl-2H-1-benzofuran-5-yl)-propan-2-ylamino]benzoic acid Traditional Name: 2-[isopropyl-(7-isopropyl-3,3-dimethyl-coumaran-5-yl)amino]benzoic acid Formula: C23H29NO3 MolecularWeight: 367.48126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC(=C1)N(C3=CC=CC=C3C(=O)O)C(C)C)C(CO2)(C)C

Isomeric SMILES

CC(C)C1=C2C(=CC(=C1)N(C3=CC=CC=C3C(=O)O)C(C)C)C(CO2)(C)C

InChI

InChI=1S/C23H29NO3/c1-14(2)18-11-16(12-19-21(18)27-13-23(19,5)6)24(15(3)4)20-10-8-7-9-17(20)22(25)26/h7-12,14-15H,13H2,1-6H3,(H,25,26)