1-(3-nitropyren-4-yl)ethanol

Systemtic Name: 1-(3-nitropyren-4-yl)ethanol Openeye Name: 1-(3-nitropyren-4-yl)ethanol CAS Name: 1-(3-nitro-4-pyrenyl)ethanol IUPAC Name: 1-(3-nitropyren-4-yl)ethanol Traditional Name: 1-(3-nitropyren-4-yl)ethanol Formula: C18H13NO3 MolecularWeight: 291.30072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC3=C2C4=C(C=C3)C=CC(=C14)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=CC2=CC=CC3=C2C4=C(C=C3)C=CC(=C14)[N+](=O)[O-])O

InChI

InChI=1S/C18H13NO3/c1-10(20)14-9-13-4-2-3-11-5-6-12-7-8-15(19(21)22)18(14)17(12)16(11)13/h2-10,20H,1H3