4-[(3,5-dimethylphenyl)carbamoylamino]butanoate

Systemtic Name: 4-[(3,5-dimethylphenyl)carbamoylamino]butanoate Openeye Name: 4-[(3,5-dimethylphenyl)carbamoylamino]butanoate CAS Name: 4-[[(3,5-dimethylanilino)-oxomethyl]amino]butanoate IUPAC Name: 4-[(3,5-dimethylphenyl)carbamoylamino]butanoate Traditional Name: 4-[(3,5-dimethylphenyl)carbamoylamino]butyrate Formula: C13H17N2O3- MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NCCCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NCCCC(=O)[O-])C

InChI

InChI=1S/C13H18N2O3/c1-9-6-10(2)8-11(7-9)15-13(18)14-5-3-4-12(16)17/h6-8H,3-5H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1