5-oxidanylidene-2-[(phenylmethyl)-[2-(undecanoylamino)propanoyl]amino]pentanoic acid

Systemtic Name: 5-oxidanylidene-2-[(phenylmethyl)-[2-(undecanoylamino)propanoyl]amino]pentanoic acid Openeye Name: 2-[benzyl-[2-(undecanoylamino)propanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-oxo-2-[[1-oxo-2-(1-oxoundecylamino)propyl]-(phenylmethyl)amino]pentanoic acid IUPAC Name: 2-[benzyl-[2-(undecanoylamino)propanoyl]amino]-5-oxopentanoic acid Traditional Name: 2-[benzyl-[2-(undecanoylamino)propanoyl]amino]-5-keto-valeric acid Formula: C26H40N2O5 MolecularWeight: 460.6062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40N2O5/c1-3-4-5-6-7-8-9-13-18-24(30)27-21(2)25(31)28(20-22-15-11-10-12-16-22)23(26(32)33)17-14-19-29/h10-12,15-16,19,21,23H,3-9,13-14,17-18,20H2,1-2H3,(H,27,30)(H,32,33)