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

Systemtic Name: 4-[[1,3-bis(oxidanyl)-1-phenyl-propan-2-yl]amino]naphthalene-1,2-dione Openeye Name: 4-[[2-hydroxy-1-(hydroxymethyl)-2-phenyl-ethyl]amino]naphthalene-1,2-dione CAS Name: 4-[(1,3-dihydroxy-1-phenylpropan-2-yl)amino]naphthalene-1,2-dione IUPAC Name: 4-[(1,3-dihydroxy-1-phenylpropan-2-yl)amino]naphthalene-1,2-dione Traditional Name: 4-[(2-hydroxy-1-methylol-2-phenyl-ethyl)amino]-1,2-naphthoquinone Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(CO)NC2=CC(=O)C(=O)C3=CC=CC=C32)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(CO)NC2=CC(=O)C(=O)C3=CC=CC=C32)O

InChI

InChI=1S/C19H17NO4/c21-11-16(18(23)12-6-2-1-3-7-12)20-15-10-17(22)19(24)14-9-5-4-8-13(14)15/h1-10,16,18,20-21,23H,11H2