2-[[3-methyl-2-[2-(octylamino)propanoylamino]butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[3-methyl-2-[2-(octylamino)propanoylamino]butanoyl]amino]ethanoic acid Openeye Name: 2-[[3-methyl-2-[2-(octylamino)propanoylamino]butanoyl]amino]acetic acid CAS Name: 2-[[3-methyl-2-[[2-(octylamino)-1-oxopropyl]amino]-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[[3-methyl-2-[2-(octylamino)propanoylamino]butanoyl]amino]acetic acid Traditional Name: 2-[[3-methyl-2-[2-(octylamino)propanoylamino]butanoyl]amino]acetic acid Formula: C18H35N3O4 MolecularWeight: 357.4882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(C)C(=O)NC(C(C)C)C(=O)NCC(=O)O

Isomeric SMILES

CCCCCCCCNC(C)C(=O)NC(C(C)C)C(=O)NCC(=O)O

InChI

InChI=1S/C18H35N3O4/c1-5-6-7-8-9-10-11-19-14(4)17(24)21-16(13(2)3)18(25)20-12-15(22)23/h13-14,16,19H,5-12H2,1-4H3,(H,20,25)(H,21,24)(H,22,23)