2-[[1-[2-[(1-ethoxy-1-oxidanylidene-3-phenyl-butan-2-yl)amino]propanoyl]pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[1-[2-[(1-ethoxy-1-oxidanylidene-3-phenyl-butan-2-yl)amino]propanoyl]pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[1-[2-[(1-ethoxycarbonyl-2-phenyl-propyl)amino]propanoyl]pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[1-[2-[(1-ethoxy-1-oxo-3-phenylbutan-2-yl)amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-[2-[(1-ethoxy-1-oxo-3-phenylbutan-2-yl)amino]propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-[2-[(1-carbethoxy-2-phenyl-propyl)amino]propanoyl]prolyl]amino]-4-methyl-valeric acid Formula: C26H39N3O6 MolecularWeight: 489.60436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCOC(=O)C(C(C)C1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C26H39N3O6/c1-6-35-26(34)22(17(4)19-11-8-7-9-12-19)27-18(5)24(31)29-14-10-13-21(29)23(30)28-20(25(32)33)15-16(2)3/h7-9,11-12,16-18,20-22,27H,6,10,13-15H2,1-5H3,(H,28,30)(H,32,33)