3-methyl-2-[2-[2-[(4-methylphenyl)carbonylamino]ethanoylamino]propanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[2-[(4-methylphenyl)carbonylamino]ethanoylamino]propanoylamino]butanoic acid Openeye Name: 3-methyl-2-[2-[[2-[(4-methylbenzoyl)amino]acetyl]amino]propanoylamino]butanoic acid CAS Name: 3-methyl-2-[[2-[[2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[2-[[2-[(4-methylbenzoyl)amino]acetyl]amino]propanoylamino]butanoic acid Traditional Name: 3-methyl-2-[2-[[2-(p-toluoylamino)acetyl]amino]propanoylamino]butyric acid Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)NC(C)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)NC(C)C(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C18H25N3O5/c1-10(2)15(18(25)26)21-16(23)12(4)20-14(22)9-19-17(24)13-7-5-11(3)6-8-13/h5-8,10,12,15H,9H2,1-4H3,(H,19,24)(H,20,22)(H,21,23)(H,25,26)