(2S)-2-[(3-ethylphenyl)carbamoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(3-ethylphenyl)carbamoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(3-ethylphenyl)carbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(3-ethylanilino)-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(3-ethylphenyl)carbamoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(3-ethylphenyl)carbamoylamino]-4-methyl-valerate Formula: C15H21N2O3- MolecularWeight: 277.33884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC(CC(C)C)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N[C@@H](CC(C)C)C(=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-4-11-6-5-7-12(9-11)16-15(20)17-13(14(18)19)8-10(2)3/h5-7,9-10,13H,4,8H2,1-3H3,(H,18,19)(H2,16,17,20)/p-1/t13-/m0/s1