4-oxidanyl-3-[(phenylmethyl)amino]naphthalene-1,2-dione

Systemtic Name: 4-oxidanyl-3-[(phenylmethyl)amino]naphthalene-1,2-dione Openeye Name: 3-(benzylamino)-4-hydroxy-naphthalene-1,2-dione CAS Name: 4-hydroxy-3-[(phenylmethyl)amino]naphthalene-1,2-dione IUPAC Name: 3-(benzylamino)-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-(benzylamino)-4-hydroxy-1,2-naphthoquinone Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C17H13NO3/c19-15-12-8-4-5-9-13(12)16(20)17(21)14(15)18-10-11-6-2-1-3-7-11/h1-9,18-19H,10H2