2-[[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]amino]naphthalene-1,4-dione

Systemtic Name: 2-[[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]amino]naphthalene-1,4-dione Openeye Name: 2-[[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]amino]naphthalene-1,4-dione CAS Name: 2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]naphthalene-1,4-dione IUPAC Name: 2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]naphthalene-1,4-dione Traditional Name: 2-[(2-hydroxy-1,1-dimethylol-ethyl)amino]-1,4-naphthoquinone Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO5/c16-6-14(7-17,8-18)15-11-5-12(19)9-3-1-2-4-10(9)13(11)20/h1-5,15-18H,6-8H2