dimethyl-[(1S)-2-[2-(4-nitrophenyl)ethanoylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[2-(4-nitrophenyl)ethanoylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[[2-(4-nitrophenyl)acetyl]amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[[2-(4-nitrophenyl)acetyl]amino]-1-phenylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[[2-(4-nitrophenyl)acetyl]amino]-1-phenyl-ethyl]ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3/c1-20(2)17(15-6-4-3-5-7-15)13-19-18(22)12-14-8-10-16(11-9-14)21(23)24/h3-11,17H,12-13H2,1-2H3,(H,19,22)/p+1/t17-/m1/s1