2-[[3-(1-butanoylpiperidin-2-yl)phenyl]methyl]-5,6-dimethoxy-3-methyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[[3-(1-butanoylpiperidin-2-yl)phenyl]methyl]-5,6-dimethoxy-3-methyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[[3-(1-butanoyl-2-piperidyl)phenyl]methyl]-5,6-dimethoxy-3-methyl-1,4-benzoquinone CAS Name: 2,3-dimethoxy-5-methyl-6-[[3-[1-(1-oxobutyl)-2-piperidinyl]phenyl]methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[[3-(1-butanoylpiperidin-2-yl)phenyl]methyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[3-(1-butyryl-2-piperidyl)benzyl]-5,6-dimethoxy-3-methyl-p-benzoquinone Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCCCC1C2=CC(=CC=C2)CC3=C(C(=O)C(=C(C3=O)OC)OC)C

Isomeric SMILES

CCCC(=O)N1CCCCC1C2=CC(=CC=C2)CC3=C(C(=O)C(=C(C3=O)OC)OC)C

InChI

InChI=1S/C25H31NO5/c1-5-9-21(27)26-13-7-6-12-20(26)18-11-8-10-17(14-18)15-19-16(2)22(28)24(30-3)25(31-4)23(19)29/h8,10-11,14,20H,5-7,9,12-13,15H2,1-4H3