2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]ethyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]ethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-isobenzofuran-1-yl]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-1-isobenzofuranyl]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]ethyl-methylamino]acetic acid Traditional Name: 2-[2-[1-(4-chlorophenyl)-3,3-dimethyl-phthalan-1-yl]ethyl-methyl-amino]acetic acid Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(O1)(CCN(C)CC(=O)O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(O1)(CCN(C)CC(=O)O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H24ClNO3/c1-20(2)17-6-4-5-7-18(17)21(26-20,12-13-23(3)14-19(24)25)15-8-10-16(22)11-9-15/h4-11H,12-14H2,1-3H3,(H,24,25)