(3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) 2,2-bis(chloranyl)propanoate

Systemtic Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) 2,2-bis(chloranyl)propanoate Openeye Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-benzofuran-5-yl) 2,2-dichloropropanoate CAS Name: 2,2-dichloropropanoic acid [3,3-dimethyl-2-(1-pyrrolidinyl)-2H-benzofuran-5-yl] ester IUPAC Name: (3,3-dimethyl-2-pyrrolidin-1-yl-2H-1-benzofuran-5-yl) 2,2-dichloropropanoate Traditional Name: 2,2-dichloropropionic acid (3,3-dimethyl-2-pyrrolidino-coumaran-5-yl) ester Formula: C17H21Cl2NO3 MolecularWeight: 358.25954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=C(C=C2)OC(=O)C(C)(Cl)Cl)N3CCCC3)C

Isomeric SMILES

CC1(C(OC2=C1C=C(C=C2)OC(=O)C(C)(Cl)Cl)N3CCCC3)C

InChI

InChI=1S/C17H21Cl2NO3/c1-16(2)12-10-11(22-15(21)17(3,18)19)6-7-13(12)23-14(16)20-8-4-5-9-20/h6-7,10,14H,4-5,8-9H2,1-3H3