(2S,3S)-2-[(3-chloranyl-2-methyl-phenyl)carbamoylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3S)-2-[(3-chloranyl-2-methyl-phenyl)carbamoylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3S)-2-[(3-chloro-2-methyl-phenyl)carbamoylamino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-2-[[(3-chloro-2-methylanilino)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: (2S,3S)-2-[(3-chloro-2-methylphenyl)carbamoylamino]-3-methylpentanoic acid Traditional Name: (2S,3S)-2-[(3-chloro-2-methyl-phenyl)carbamoylamino]-3-methyl-valeric acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C14H19ClN2O3/c1-4-8(2)12(13(18)19)17-14(20)16-11-7-5-6-10(15)9(11)3/h5-8,12H,4H2,1-3H3,(H,18,19)(H2,16,17,20)/t8-,12-/m0/s1