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

Systemtic Name: ethyl 2-methyl-4-[(4-methylphenyl)-(4-methylpiperidin-1-yl)methyl]-5-oxidanyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-4-[(4-methyl-1-piperidyl)-(p-tolyl)methyl]benzo[g]benzofuran-3-carboxylate CAS Name: 5-hydroxy-2-methyl-4-[(4-methylphenyl)-(4-methyl-1-piperidinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-4-[(4-methylphenyl)-(4-methylpiperidin-1-yl)methyl]benzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-4-[(4-methylpiperidino)-(p-tolyl)methyl]benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C30H33NO4 MolecularWeight: 471.58732

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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=C(C=C4)C)N5CCC(CC5)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)C(C4=CC=C(C=C4)C)N5CCC(CC5)C)C

InChI

InChI=1S/C30H33NO4/c1-5-34-30(33)24-20(4)35-29-23-9-7-6-8-22(23)28(32)26(25(24)29)27(21-12-10-18(2)11-13-21)31-16-14-19(3)15-17-31/h6-13,19,27,32H,5,14-17H2,1-4H3