4-methyl-3-[[(2S)-2-methylpentanoyl]amino]benzoate

Systemtic Name: 4-methyl-3-[[(2S)-2-methylpentanoyl]amino]benzoate Openeye Name: 4-methyl-3-[[(2S)-2-methylpentanoyl]amino]benzoate CAS Name: 4-methyl-3-[[(2S)-2-methyl-1-oxopentyl]amino]benzoate IUPAC Name: 4-methyl-3-[[(2S)-2-methylpentanoyl]amino]benzoate Traditional Name: 4-methyl-3-[[(2S)-2-methylpentanoyl]amino]benzoate Formula: C14H18NO3- MolecularWeight: 248.29762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=C(C=CC(=C1)C(=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-4-5-10(3)13(16)15-12-8-11(14(17)18)7-6-9(12)2/h6-8,10H,4-5H2,1-3H3,(H,15,16)(H,17,18)/p-1/t10-/m0/s1