2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-3-(4-azido-2-nitro-phenyl)propanoic acid

Systemtic Name: 2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-3-(4-azido-2-nitro-phenyl)propanoic acid Openeye Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-3-(4-azido-2-nitro-phenyl)propanoic acid CAS Name: 2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-4-methyl-1-oxopentyl]amino]-3-(4-azido-2-nitrophenyl)propanoic acid IUPAC Name: 2-[[2-[(2-amino-4-methylpentanoyl)amino]-4-methylpentanoyl]amino]-3-(4-azido-2-nitrophenyl)propanoic acid Traditional Name: 2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-3-(4-azido-2-nitro-phenyl)propionic acid Formula: C21H31N7O6 MolecularWeight: 477.51414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N7O6/c1-11(2)7-15(22)19(29)24-16(8-12(3)4)20(30)25-17(21(31)32)9-13-5-6-14(26-27-23)10-18(13)28(33)34/h5-6,10-12,15-17H,7-9,22H2,1-4H3,(H,24,29)(H,25,30)(H,31,32)