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6-nitropyrene-2-carboxylate

6-nitropyrene-2-carboxylate

Systemtic Name:6-nitropyrene-2-carboxylate
Openeye Name:6-nitropyrene-2-carboxylate
CAS Name:6-nitro-2-pyrenecarboxylate
IUPAC Name:6-nitropyrene-2-carboxylate
Traditional Name:6-nitropyrene-2-carboxylate
Formula: C17H8NO4-
MolecularWeight: 290.24972
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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)/p-1


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