4-[[3-azanyl-5-(hydroxymethyl)-1H-pyrazol-4-yl]imino]-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[3-azanyl-5-(hydroxymethyl)-1H-pyrazol-4-yl]imino]-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[3-amino-5-(hydroxymethyl)-1H-pyrazol-4-yl]imino]-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[[3-amino-5-(hydroxymethyl)-1H-pyrazol-4-yl]imino]-5-(2-hydroxyethylamino)-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[3-amino-5-(hydroxymethyl)-1H-pyrazol-4-yl]imino]-5-(2-hydroxyethylamino)-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 4-[(3-amino-5-methylol-1H-pyrazol-4-yl)imino]-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(NN=C2N)CO)C(=CC1=O)NCCO

Isomeric SMILES

CC1=CC(=NC2=C(NN=C2N)CO)C(=CC1=O)NCCO

InChI

InChI=1S/C13H17N5O3/c1-7-4-9(8(5-11(7)21)15-2-3-19)16-12-10(6-20)17-18-13(12)14/h4-5,15,19-20H,2-3,6H2,1H3,(H3,14,17,18)