(2S,3S)-2-[(4-ethanoylpiperazin-1-yl)carbonylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[(4-ethanoylpiperazin-1-yl)carbonylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[(4-acetylpiperazine-1-carbonyl)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(4-acetyl-1-piperazinyl)-oxomethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[(4-acetylpiperazine-1-carbonyl)amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(4-acetylpiperazine-1-carbonyl)amino]-3-methyl-valerate Formula: C13H22N3O4- MolecularWeight: 284.33148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)N1CCN(CC1)C(=O)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)N1CCN(CC1)C(=O)C

InChI

InChI=1S/C13H23N3O4/c1-4-9(2)11(12(18)19)14-13(20)16-7-5-15(6-8-16)10(3)17/h9,11H,4-8H2,1-3H3,(H,14,20)(H,18,19)/p-1/t9-,11-/m0/s1