methyl 2-[2-ethyl-6-(4-methylpiperazin-1-yl)carbonyl-3,5-bis(oxidanyl)phenyl]ethanoate

Systemtic Name: methyl 2-[2-ethyl-6-(4-methylpiperazin-1-yl)carbonyl-3,5-bis(oxidanyl)phenyl]ethanoate Openeye Name: methyl 2-[2-ethyl-3,5-dihydroxy-6-(4-methylpiperazine-1-carbonyl)phenyl]acetate CAS Name: 2-[2-ethyl-3,5-dihydroxy-6-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-ethyl-3,5-dihydroxy-6-(4-methylpiperazine-1-carbonyl)phenyl]acetate Traditional Name: 2-[2-ethyl-3,5-dihydroxy-6-(4-methylpiperazine-1-carbonyl)phenyl]acetic acid methyl ester Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1CC(=O)OC)C(=O)N2CCN(CC2)C)O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1CC(=O)OC)C(=O)N2CCN(CC2)C)O)O

InChI

InChI=1S/C17H24N2O5/c1-4-11-12(9-15(22)24-3)16(14(21)10-13(11)20)17(23)19-7-5-18(2)6-8-19/h10,20-21H,4-9H2,1-3H3