2-chloranyl-3-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]naphthalene-1,4-dione CAS Name: 2-chloro-3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-1,4-naphthoquinone Formula: C18H13ClN2O5 MolecularWeight: 372.75922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H13ClN2O5/c19-15-16(18(24)13-4-2-1-3-12(13)17(15)23)20-9-14(22)10-5-7-11(8-6-10)21(25)26/h1-8,14,20,22H,9H2