4-[2-[2-(2-acetamidocyclohexyl)oxypropanoylamino]propanoyl-(phenylmethyl)amino]-5-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[2-[2-(2-acetamidocyclohexyl)oxypropanoylamino]propanoyl-(phenylmethyl)amino]-5-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 4-[2-[2-(2-acetamidocyclohexoxy)propanoylamino]propanoyl-benzyl-amino]-5-amino-5-oxo-pentanoic acid CAS Name: 4-[[2-[[2-(2-acetamidocyclohexyl)oxy-1-oxopropyl]amino]-1-oxopropyl]-(phenylmethyl)amino]-5-amino-5-oxopentanoic acid IUPAC Name: 4-[2-[2-(2-acetamidocyclohexyl)oxypropanoylamino]propanoyl-benzylamino]-5-amino-5-oxopentanoic acid Traditional Name: 4-[2-[2-(2-acetamidocyclohexoxy)propanoylamino]propanoyl-benzyl-amino]-5-amino-5-keto-valeric acid Formula: C26H38N4O7 MolecularWeight: 518.60252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)C(CCC(=O)O)C(=O)N)NC(=O)C(C)OC2CCCCC2NC(=O)C

Isomeric SMILES

CC(C(=O)N(CC1=CC=CC=C1)C(CCC(=O)O)C(=O)N)NC(=O)C(C)OC2CCCCC2NC(=O)C

InChI

InChI=1S/C26H38N4O7/c1-16(28-25(35)17(2)37-22-12-8-7-11-20(22)29-18(3)31)26(36)30(15-19-9-5-4-6-10-19)21(24(27)34)13-14-23(32)33/h4-6,9-10,16-17,20-22H,7-8,11-15H2,1-3H3,(H2,27,34)(H,28,35)(H,29,31)(H,32,33)