5,8-bis(oxidanyl)-2-[(phenylmethyl)amino]naphthalene-1,4-dione

Systemtic Name: 5,8-bis(oxidanyl)-2-[(phenylmethyl)amino]naphthalene-1,4-dione Openeye Name: 2-(benzylamino)-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 5,8-dihydroxy-2-[(phenylmethyl)amino]naphthalene-1,4-dione IUPAC Name: 2-(benzylamino)-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 2-(benzylamino)-5,8-dihydroxy-1,4-naphthoquinone Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC(=O)C3=C(C=CC(=C3C2=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC(=O)C3=C(C=CC(=C3C2=O)O)O

InChI

InChI=1S/C17H13NO4/c19-12-6-7-13(20)16-15(12)14(21)8-11(17(16)22)18-9-10-4-2-1-3-5-10/h1-8,18-20H,9H2