N-ethanoyl-N-(7-nitropyren-1-yl)ethanamide

Systemtic Name: N-ethanoyl-N-(7-nitropyren-1-yl)ethanamide Openeye Name: N-acetyl-N-(7-nitropyren-1-yl)acetamide CAS Name: N-acetyl-N-(7-nitro-1-pyrenyl)acetamide IUPAC Name: N-acetyl-N-(7-nitropyren-1-yl)acetamide Traditional Name: N-acetyl-N-(7-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=C4C2=C(C=CC4=CC(=C3)[N+](=O)[O-])C=C1)C(=O)C

Isomeric SMILES

CC(=O)N(C1=C2C=CC3=C4C2=C(C=CC4=CC(=C3)[N+](=O)[O-])C=C1)C(=O)C

InChI

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