2-[[(2S)-3-(4-methylphenoxy)-2-oxidanyl-propyl]carbamoyl]benzoate

Systemtic Name: 2-[[(2S)-3-(4-methylphenoxy)-2-oxidanyl-propyl]carbamoyl]benzoate Openeye Name: 2-[[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]carbamoyl]benzoate CAS Name: 2-[[[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]amino]-oxomethyl]benzoate IUPAC Name: 2-[[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]carbamoyl]benzoate Traditional Name: 2-[[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]carbamoyl]benzoate Formula: C18H18NO5- MolecularWeight: 328.33922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(CNC(=O)C2=CC=CC=C2C(=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)OC[C@H](CNC(=O)C2=CC=CC=C2C(=O)[O-])O

InChI

InChI=1S/C18H19NO5/c1-12-6-8-14(9-7-12)24-11-13(20)10-19-17(21)15-4-2-3-5-16(15)18(22)23/h2-9,13,20H,10-11H2,1H3,(H,19,21)(H,22,23)/p-1/t13-/m0/s1