[(1S)-2-[(4-ethanoyl-2-nitro-phenyl)amino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[(4-ethanoyl-2-nitro-phenyl)amino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-(4-acetyl-2-nitro-anilino)-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-(4-acetyl-2-nitroanilino)-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-(4-acetyl-2-nitroanilino)-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-(4-acetyl-2-nitro-anilino)-1-phenyl-ethyl]-diethyl-ammonium Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C20H25N3O3/c1-4-22(5-2)20(16-9-7-6-8-10-16)14-21-18-12-11-17(15(3)24)13-19(18)23(25)26/h6-13,20-21H,4-5,14H2,1-3H3/p+1/t20-/m1/s1