4-[[(2S)-butan-2-yl]carbamoylamino]benzoate

Systemtic Name: 4-[[(2S)-butan-2-yl]carbamoylamino]benzoate Openeye Name: 4-[[(1S)-1-methylpropyl]carbamoylamino]benzoate CAS Name: 4-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]benzoate IUPAC Name: 4-[[(2S)-butan-2-yl]carbamoylamino]benzoate Traditional Name: 4-[[(1S)-1-methylpropyl]carbamoylamino]benzoate Formula: C12H15N2O3- MolecularWeight: 235.2591

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-3-8(2)13-12(17)14-10-6-4-9(5-7-10)11(15)16/h4-8H,3H2,1-2H3,(H,15,16)(H2,13,14,17)/p-1/t8-/m0/s1