(E)-3-azanyl-5-[(4-methylpentanoylamino)-(2-methylpropyl)amino]-5-(oxidanylcarbamoyl)-4-oxidanylidene-8-phenyl-oct-7-enoic acid

Systemtic Name: (E)-3-azanyl-5-[(4-methylpentanoylamino)-(2-methylpropyl)amino]-5-(oxidanylcarbamoyl)-4-oxidanylidene-8-phenyl-oct-7-enoic acid Openeye Name: (E)-3-amino-5-(hydroxycarbamoyl)-5-[isobutyl-(4-methylpentanoylamino)amino]-4-oxo-8-phenyl-oct-7-enoic acid CAS Name: (E)-3-amino-5-[(hydroxyamino)-oxomethyl]-5-[[(4-methyl-1-oxopentyl)amino]-(2-methylpropyl)amino]-4-oxo-8-phenyl-7-octenoic acid IUPAC Name: (E)-3-amino-5-(hydroxycarbamoyl)-5-[(4-methylpentanoylamino)-(2-methylpropyl)amino]-4-oxo-8-phenyloct-7-enoic acid Traditional Name: (E)-3-amino-5-(hydroxycarbamoyl)-5-[isobutyl-(4-methylpentanoylamino)amino]-4-keto-8-phenyl-oct-7-enoic acid Formula: C25H38N4O6 MolecularWeight: 490.59242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NN(CC(C)C)C(CC=CC1=CC=CC=C1)(C(=O)C(CC(=O)O)N)C(=O)NO

Isomeric SMILES

CC(C)CCC(=O)NN(CC(C)C)C(C/C=C/C1=CC=CC=C1)(C(=O)C(CC(=O)O)N)C(=O)NO

InChI

InChI=1S/C25H38N4O6/c1-17(2)12-13-21(30)27-29(16-18(3)4)25(24(34)28-35,23(33)20(26)15-22(31)32)14-8-11-19-9-6-5-7-10-19/h5-11,17-18,20,35H,12-16,26H2,1-4H3,(H,27,30)(H,28,34)(H,31,32)/b11-8+