(2S)-2-acetamido-N-[2-[(4-nitrophenyl)amino]ethanoyl]-3-phenyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-[2-[(4-nitrophenyl)amino]ethanoyl]-3-phenyl-propanamide Openeye Name: (2S)-2-acetamido-N-[2-(4-nitroanilino)acetyl]-3-phenyl-propanamide CAS Name: (2S)-2-acetamido-N-[2-(4-nitroanilino)-1-oxoethyl]-3-phenylpropanamide IUPAC Name: (2S)-2-acetamido-N-[2-(4-nitroanilino)acetyl]-3-phenylpropanamide Traditional Name: (2S)-2-acetamido-N-[2-(4-nitroanilino)acetyl]-3-phenyl-propionamide Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(=O)CNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)CNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5/c1-13(24)21-17(11-14-5-3-2-4-6-14)19(26)22-18(25)12-20-15-7-9-16(10-8-15)23(27)28/h2-10,17,20H,11-12H2,1H3,(H,21,24)(H,22,25,26)/t17-/m0/s1