N-ethanoyl-N-(8-nitropyren-1-yl)ethanamide

Systemtic Name: N-ethanoyl-N-(8-nitropyren-1-yl)ethanamide Openeye Name: N-acetyl-N-(8-nitropyren-1-yl)acetamide CAS Name: N-acetyl-N-(8-nitro-1-pyrenyl)acetamide IUPAC Name: N-acetyl-N-(8-nitropyren-1-yl)acetamide Traditional Name: N-acetyl-N-(8-nitropyren-1-yl)acetamide Formula: C20H14N2O4 MolecularWeight: 346.33616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=C2C=CC3=C(C=CC4=C3C2=C(C=C4)C=C1)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC(=O)N(C1=C2C=CC3=C(C=CC4=C3C2=C(C=C4)C=C1)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C20H14N2O4/c1-11(23)21(12(2)24)17-9-5-13-3-4-14-6-10-18(22(25)26)16-8-7-15(17)19(13)20(14)16/h3-10H,1-2H3