2-[[[(2R)-2-benzamido-3-phenyl-propanoyl]amino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[[(2R)-2-benzamido-3-phenyl-propanoyl]amino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[(2R)-2-benzamido-3-phenyl-propanoyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(2R)-2-benzamido-1-oxo-3-phenylpropyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[(2R)-2-benzamido-3-phenylpropanoyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[(2R)-2-benzamido-3-phenyl-propanoyl]amino]methyl]-4-nitro-phenolate Formula: C23H20N3O5- MolecularWeight: 418.422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H21N3O5/c27-21-12-11-19(26(30)31)14-18(21)15-24-23(29)20(13-16-7-3-1-4-8-16)25-22(28)17-9-5-2-6-10-17/h1-12,14,20,27H,13,15H2,(H,24,29)(H,25,28)/p-1/t20-/m1/s1