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

Systemtic Name: ethyl 2-methyl-5-oxidanyl-4-[pyridin-4-yl(pyrrolidin-1-yl)methyl]benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-4-[4-pyridyl(pyrrolidin-1-yl)methyl]benzo[g]benzofuran-3-carboxylate CAS Name: 5-hydroxy-2-methyl-4-[pyridin-4-yl(1-pyrrolidinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-4-[pyridin-4-yl(pyrrolidin-1-yl)methyl]benzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-4-[4-pyridyl(pyrrolidino)methyl]benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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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=NC=C4)N5CCCC5)C

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4/c1-3-31-26(30)20-16(2)32-25-19-9-5-4-8-18(19)24(29)22(21(20)25)23(28-14-6-7-15-28)17-10-12-27-13-11-17/h4-5,8-13,23,29H,3,6-7,14-15H2,1-2H3