(2S)-3-methyl-2-[4-[methyl-(1-methylpiperidin-4-yl)amino]butanoylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[4-[methyl-(1-methylpiperidin-4-yl)amino]butanoylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[4-[methyl-(1-methyl-4-piperidyl)amino]butanoylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[4-[methyl-(1-methyl-4-piperidinyl)amino]-1-oxobutyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[4-[methyl-(1-methylpiperidin-4-yl)amino]butanoylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[4-[methyl-(1-methyl-4-piperidyl)amino]butanoylamino]butyric acid Formula: C16H31N3O3 MolecularWeight: 313.43564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCCN(C)C1CCN(CC1)C

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CCCN(C)C1CCN(CC1)C

InChI

InChI=1S/C16H31N3O3/c1-12(2)15(16(21)22)17-14(20)6-5-9-19(4)13-7-10-18(3)11-8-13/h12-13,15H,5-11H2,1-4H3,(H,17,20)(H,21,22)/t15-/m0/s1