2-[[(1R)-1-(4-methylphenyl)propyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(1R)-1-(4-methylphenyl)propyl]iminomethyl]-4-nitro-phenolate Openeye Name: 4-nitro-2-[[(1R)-1-(p-tolyl)propyl]iminomethyl]phenolate CAS Name: 2-[[(1R)-1-(4-methylphenyl)propyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(1R)-1-(4-methylphenyl)propyl]iminomethyl]-4-nitrophenolate Traditional Name: 4-nitro-2-[[(1R)-1-(p-tolyl)propyl]iminomethyl]phenolate Formula: C17H17N2O3- MolecularWeight: 297.32848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H18N2O3/c1-3-16(13-6-4-12(2)5-7-13)18-11-14-10-15(19(21)22)8-9-17(14)20/h4-11,16,20H,3H2,1-2H3/p-1/t16-/m1/s1