1-(6-nitropyren-1-yl)ethanone

Systemtic Name: 1-(6-nitropyren-1-yl)ethanone Openeye Name: 1-(6-nitropyren-1-yl)ethanone CAS Name: 1-(6-nitro-1-pyrenyl)ethanone IUPAC Name: 1-(6-nitropyren-1-yl)ethanone Traditional Name: 1-(6-nitropyren-1-yl)ethanone Formula: C18H11NO3 MolecularWeight: 289.28484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11NO3/c1-10(20)13-6-2-11-4-8-15-16(19(21)22)9-5-12-3-7-14(13)17(11)18(12)15/h2-9H,1H3