(4-nitrophenyl) 2-[(2-azanyl-3-phenyl-propanoyl)amino]ethanoate hydrobromide

Systemtic Name: (4-nitrophenyl) 2-[(2-azanyl-3-phenyl-propanoyl)amino]ethanoate hydrobromide Openeye Name: (4-nitrophenyl) 2-[(2-amino-3-phenyl-propanoyl)amino]acetate hydrobromide CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)amino]acetic acid (4-nitrophenyl) ester hydrobromide IUPAC Name: (4-nitrophenyl) 2-[(2-amino-3-phenylpropanoyl)amino]acetate hydrobromide Traditional Name: 2-(phenylalanylamino)acetic acid (4-nitrophenyl) ester hydrobromide Formula: C17H18BrN3O5 MolecularWeight: 424.24592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])N.Br

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])N.Br

InChI

InChI=1S/C17H17N3O5.BrH/c18-15(10-12-4-2-1-3-5-12)17(22)19-11-16(21)25-14-8-6-13(7-9-14)20(23)24;/h1-9,15H,10-11,18H2,(H,19,22);1H