2-[2-[2-(2-azanylethanoylamino)ethanoylamino]ethanoylamino]-3-(4-nitrophenyl)propanoic acid

Systemtic Name: 2-[2-[2-(2-azanylethanoylamino)ethanoylamino]ethanoylamino]-3-(4-nitrophenyl)propanoic acid Openeye Name: 2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoic acid CAS Name: 2-[[2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: 2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoic acid Traditional Name: 2-[[2-[[2-(glycylamino)acetyl]amino]acetyl]amino]-3-(4-nitrophenyl)propionic acid Formula: C15H19N5O7 MolecularWeight: 381.34066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)CNC(=O)CNC(=O)CN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)CNC(=O)CNC(=O)CN)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O7/c16-6-12(21)17-7-13(22)18-8-14(23)19-11(15(24)25)5-9-1-3-10(4-2-9)20(26)27/h1-4,11H,5-8,16H2,(H,17,21)(H,18,22)(H,19,23)(H,24,25)