2-azanyl-7-oxidanylidene-7-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-6-[[5-oxidanyl-5-oxidanylidene-4-[2-(propoxycarbonylamino)propanoylamino]pentanoyl]amino]heptanoic acid

Systemtic Name: 2-azanyl-7-oxidanylidene-7-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-6-[[5-oxidanyl-5-oxidanylidene-4-[2-(propoxycarbonylamino)propanoylamino]pentanoyl]amino]heptanoic acid Openeye Name: 2-amino-7-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]-6-[[5-hydroxy-5-oxo-4-[2-(propoxycarbonylamino)propanoylamino]pentanoyl]amino]-7-oxo-heptanoic acid CAS Name: 2-amino-6-[[5-hydroxy-1,5-dioxo-4-[[1-oxo-2-[[oxo(propoxy)methyl]amino]propyl]amino]pentyl]amino]-7-[(1-hydroxy-1-oxopropan-2-yl)amino]-7-oxoheptanoic acid IUPAC Name: 2-amino-7-[(1-hydroxy-1-oxopropan-2-yl)amino]-6-[[5-hydroxy-5-oxo-4-[2-(propoxycarbonylamino)propanoylamino]pentanoyl]amino]-7-oxoheptanoic acid Traditional Name: 2-amino-7-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]-6-[[5-hydroxy-5-keto-4-[2-(propoxycarbonylamino)propanoylamino]pentanoyl]amino]-7-keto-enanthic acid Formula: C22H37N5O11 MolecularWeight: 547.55608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(C(=O)O)N)C(=O)NC(C)C(=O)O)C(=O)O

Isomeric SMILES

CCCOC(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(C(=O)O)N)C(=O)NC(C)C(=O)O)C(=O)O

InChI

InChI=1S/C22H37N5O11/c1-4-10-38-22(37)25-11(2)17(29)27-15(21(35)36)8-9-16(28)26-14(7-5-6-13(23)20(33)34)18(30)24-12(3)19(31)32/h11-15H,4-10,23H2,1-3H3,(H,24,30)(H,25,37)(H,26,28)(H,27,29)(H,31,32)(H,33,34)(H,35,36)