(2S)-4-methyl-2-[3-(4-methylpiperazin-1-yl)propanoylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[3-(4-methylpiperazin-1-yl)propanoylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[3-(4-methylpiperazin-1-yl)propanoylamino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[3-(4-methyl-1-piperazinyl)-1-oxopropyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[3-(4-methylpiperazin-1-yl)propanoylamino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[3-(4-methylpiperazino)propanoylamino]valeric acid Formula: C14H27N3O3 MolecularWeight: 285.38248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CCN1CCN(CC1)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)CCN1CCN(CC1)C

InChI

InChI=1S/C14H27N3O3/c1-11(2)10-12(14(19)20)15-13(18)4-5-17-8-6-16(3)7-9-17/h11-12H,4-10H2,1-3H3,(H,15,18)(H,19,20)/t12-/m0/s1