dimethyl-[(1S)-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(4-methyl-3-nitro-benzoyl)amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(4-methyl-3-nitrobenzoyl)amino]-1-phenylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[(4-methyl-3-nitro-benzoyl)amino]-1-phenyl-ethyl]ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3/c1-13-9-10-15(11-16(13)21(23)24)18(22)19-12-17(20(2)3)14-7-5-4-6-8-14/h4-11,17H,12H2,1-3H3,(H,19,22)/p+1/t17-/m1/s1