[(1R)-2-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-ethoxycarbonyl-5-nitro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-ethoxycarbonyl-5-nitrobenzoyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-carbethoxy-5-nitro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C20H24N3O5+ MolecularWeight: 386.42166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5/c1-4-28-20(25)16-10-15(11-17(12-16)23(26)27)19(24)21-13-18(22(2)3)14-8-6-5-7-9-14/h5-12,18H,4,13H2,1-3H3,(H,21,24)/p+1/t18-/m0/s1