ethyl 4-[(2-chlorophenyl)-pyrrolidin-1-yl-methyl]-2-methyl-5-oxidanyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 4-[(2-chlorophenyl)-pyrrolidin-1-yl-methyl]-2-methyl-5-oxidanyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 4-[(2-chlorophenyl)-pyrrolidin-1-yl-methyl]-5-hydroxy-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 4-[(2-chlorophenyl)-(1-pyrrolidinyl)methyl]-5-hydroxy-2-methyl-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chlorophenyl)-pyrrolidin-1-ylmethyl]-5-hydroxy-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 4-[(2-chlorophenyl)-pyrrolidino-methyl]-5-hydroxy-2-methyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C27H26ClNO4 MolecularWeight: 463.95264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)C(C4=CC=CC=C4Cl)N5CCCC5)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)C(C4=CC=CC=C4Cl)N5CCCC5)C

InChI

InChI=1S/C27H26ClNO4/c1-3-32-27(31)21-16(2)33-26-18-11-5-4-10-17(18)25(30)23(22(21)26)24(29-14-8-9-15-29)19-12-6-7-13-20(19)28/h4-7,10-13,24,30H,3,8-9,14-15H2,1-2H3