(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Openeye Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone CAS Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]methanone IUPAC Name: (5-chloro-2,3-dihydro-1-benzofuran-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methanone Traditional Name: (5-chlorocoumaran-2-yl)-[2-(3,4-dimethoxyphenyl)pyrrolidino]methanone Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)C3CC4=C(O3)C=CC(=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)C3CC4=C(O3)C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H22ClNO4/c1-25-18-7-5-13(11-19(18)26-2)16-4-3-9-23(16)21(24)20-12-14-10-15(22)6-8-17(14)27-20/h5-8,10-11,16,20H,3-4,9,12H2,1-2H3