2-[[(2S)-2-(2-chlorophenyl)-2-(diethylazaniumyl)ethyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2S)-2-(2-chlorophenyl)-2-(diethylazaniumyl)ethyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(2S)-2-(2-chlorophenyl)-2-(diethylammonio)ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(2S)-2-(2-chlorophenyl)-2-(diethylammonio)ethyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(2S)-2-(2-chlorophenyl)-2-(diethylazaniumyl)ethyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(2S)-2-(2-chlorophenyl)-2-(diethylammonio)ethyl]iminomethyl]-4-nitro-phenolate Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])C2=CC=CC=C2Cl

Isomeric SMILES

CC[NH+](CC)[C@H](CN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])C2=CC=CC=C2Cl

InChI

InChI=1S/C19H22ClN3O3/c1-3-22(4-2)18(16-7-5-6-8-17(16)20)13-21-12-14-11-15(23(25)26)9-10-19(14)24/h5-12,18,24H,3-4,13H2,1-2H3/t18-/m1/s1