methyl 2-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]hexanoate

Systemtic Name: methyl 2-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]hexanoate Openeye Name: methyl 2-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]hexanoate CAS Name: 2-[[4-methyl-1-oxo-2-[(1-oxo-4-phenylbutyl)amino]pentyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]hexanoate Traditional Name: 2-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]hexanoic acid methyl ester Formula: C23H36N2O4 MolecularWeight: 404.54294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)C(CC(C)C)NC(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)C(CC(C)C)NC(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C23H36N2O4/c1-5-6-14-19(23(28)29-4)25-22(27)20(16-17(2)3)24-21(26)15-10-13-18-11-8-7-9-12-18/h7-9,11-12,17,19-20H,5-6,10,13-16H2,1-4H3,(H,24,26)(H,25,27)