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

Systemtic Name: ethyl 4-[(4-ethylpiperazin-1-yl)-phenyl-methyl]-2-methyl-5-oxidanyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 4-[(4-ethylpiperazin-1-yl)-phenyl-methyl]-5-hydroxy-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 4-[(4-ethyl-1-piperazinyl)-phenylmethyl]-5-hydroxy-2-methyl-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethylpiperazin-1-yl)-phenylmethyl]-5-hydroxy-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 4-[(4-ethylpiperazino)-phenyl-methyl]-5-hydroxy-2-methyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C29H32N2O4 MolecularWeight: 472.57538

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C5=C3C(=C(O5)C)C(=O)OCC)O

Isomeric SMILES

CCN1CCN(CC1)C(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C5=C3C(=C(O5)C)C(=O)OCC)O

InChI

InChI=1S/C29H32N2O4/c1-4-30-15-17-31(18-16-30)26(20-11-7-6-8-12-20)25-24-23(29(33)34-5-2)19(3)35-28(24)22-14-10-9-13-21(22)27(25)32/h6-14,26,32H,4-5,15-18H2,1-3H3