6-nitropyrene-2-carboxylic acid

Systemtic Name: 6-nitropyrene-2-carboxylic acid Openeye Name: 6-nitropyrene-2-carboxylic acid CAS Name: 6-nitro-2-pyrenecarboxylic acid IUPAC Name: 6-nitropyrene-2-carboxylic acid Traditional Name: 6-nitropyrene-2-carboxylic acid Formula: C17H9NO4 MolecularWeight: 291.25766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC3=C2C4=C1C=CC(=C4C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC2=CC(=CC3=C2C4=C1C=CC(=C4C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H9NO4/c19-17(20)12-7-10-2-1-9-4-6-14(18(21)22)13-5-3-11(8-12)15(10)16(9)13/h1-8H,(H,19,20)