(2S)-2-[(3-methylphenyl)methylcarbamoylamino]pentanoic acid

Systemtic Name: (2S)-2-[(3-methylphenyl)methylcarbamoylamino]pentanoic acid Openeye Name: (2S)-2-(m-tolylmethylcarbamoylamino)pentanoic acid CAS Name: (2S)-2-[[[(3-methylphenyl)methylamino]-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-2-[(3-methylphenyl)methylcarbamoylamino]pentanoic acid Traditional Name: (2S)-2-[(3-methylbenzyl)carbamoylamino]valeric acid Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)NCC1=CC=CC(=C1)C

Isomeric SMILES

CCC[C@@H](C(=O)O)NC(=O)NCC1=CC=CC(=C1)C

InChI

InChI=1S/C14H20N2O3/c1-3-5-12(13(17)18)16-14(19)15-9-11-7-4-6-10(2)8-11/h4,6-8,12H,3,5,9H2,1-2H3,(H,17,18)(H2,15,16,19)/t12-/m0/s1