3-butyl-1-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]imino-4-oxidanyl-naphthalen-2-one

Systemtic Name: 3-butyl-1-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]imino-4-oxidanyl-naphthalen-2-one Openeye Name: 3-butyl-4-hydroxy-1-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]imino-naphthalen-2-one CAS Name: 3-butyl-1-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]imino-4-hydroxy-2-naphthalenone IUPAC Name: 3-butyl-1-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]imino-4-hydroxynaphthalen-2-one Traditional Name: 3-butyl-4-hydroxy-1-(2-hydroxy-1,1-dimethylol-ethyl)imino-naphthalen-2-one Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C(=NC(CO)(CO)CO)C1=O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C(=NC(CO)(CO)CO)C1=O)O

InChI

InChI=1S/C18H23NO5/c1-2-3-6-14-16(23)13-8-5-4-7-12(13)15(17(14)24)19-18(9-20,10-21)11-22/h4-5,7-8,20-23H,2-3,6,9-11H2,1H3