4-chloranyl-6-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C11H14ClNO3 MolecularWeight: 243.68676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC=C1C=C(C=CC1=O)Cl

Isomeric SMILES

CC(CO)(CO)NC=C1C=C(C=CC1=O)Cl

InChI

InChI=1S/C11H14ClNO3/c1-11(6-14,7-15)13-5-8-4-9(12)2-3-10(8)16/h2-5,13-15H,6-7H2,1H3