(2S,3R)-2-[(4-methanoylpiperazin-1-yl)carbonylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3R)-2-[(4-methanoylpiperazin-1-yl)carbonylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3R)-2-[(4-formylpiperazine-1-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: (2S,3R)-2-[[(4-formyl-1-piperazinyl)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: (2S,3R)-2-[(4-formylpiperazine-1-carbonyl)amino]-3-methylpentanoic acid Traditional Name: (2S,3R)-2-[(4-formylpiperazine-1-carbonyl)amino]-3-methyl-valeric acid Formula: C12H21N3O4 MolecularWeight: 271.31284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)N1CCN(CC1)C=O

Isomeric SMILES

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

InChI

InChI=1S/C12H21N3O4/c1-3-9(2)10(11(17)18)13-12(19)15-6-4-14(8-16)5-7-15/h8-10H,3-7H2,1-2H3,(H,13,19)(H,17,18)/t9-,10+/m1/s1