2-[[2-[(diethylazaniumyl)methyl]phenyl]methyliminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-[(diethylazaniumyl)methyl]phenyl]methyliminomethyl]-4-nitro-phenolate Openeye Name: 2-[[2-[(diethylammonio)methyl]phenyl]methyliminomethyl]-4-nitro-phenolate CAS Name: 2-[[2-[(diethylammonio)methyl]phenyl]methyliminomethyl]-4-nitrophenolate IUPAC Name: 2-[[2-[(diethylazaniumyl)methyl]phenyl]methyliminomethyl]-4-nitrophenolate Traditional Name: 2-[[2-[(diethylammonio)methyl]benzyl]iminomethyl]-4-nitro-phenolate Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H23N3O3/c1-3-21(4-2)14-16-8-6-5-7-15(16)12-20-13-17-11-18(22(24)25)9-10-19(17)23/h5-11,13,23H,3-4,12,14H2,1-2H3