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

Systemtic Name: diethyl-[(1S)-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-(4-methylsulfonyl-2-nitro-anilino)-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-(4-methylsulfonyl-2-nitroanilino)-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-(4-methylsulfonyl-2-nitroanilino)-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-(4-mesyl-2-nitro-anilino)-1-phenyl-ethyl]ammonium Formula: C19H26N3O4S+ MolecularWeight: 392.49244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O4S/c1-4-21(5-2)19(15-9-7-6-8-10-15)14-20-17-12-11-16(27(3,25)26)13-18(17)22(23)24/h6-13,19-20H,4-5,14H2,1-3H3/p+1/t19-/m1/s1