9-chloranyl-10-nitro-3,4-bis(oxidanyl)phenanthrene-1-carboxylic acid

Systemtic Name: 9-chloranyl-10-nitro-3,4-bis(oxidanyl)phenanthrene-1-carboxylic acid Openeye Name: 9-chloro-3,4-dihydroxy-10-nitro-phenanthrene-1-carboxylic acid CAS Name: 9-chloro-3,4-dihydroxy-10-nitro-1-phenanthrenecarboxylic acid IUPAC Name: 9-chloro-3,4-dihydroxy-10-nitrophenanthrene-1-carboxylic acid Traditional Name: 9-chloro-3,4-dihydroxy-10-nitro-phenanthrene-1-carboxylic acid Formula: C15H8ClNO6 MolecularWeight: 333.68012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C(=CC(=C3O)O)C(=O)O)C(=C2Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C(=CC(=C3O)O)C(=O)O)C(=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H8ClNO6/c16-12-7-4-2-1-3-6(7)11-10(13(12)17(22)23)8(15(20)21)5-9(18)14(11)19/h1-5,18-19H,(H,20,21)