[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 3-methyl-2-oxidanyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 3-methyl-2-oxidanyl-benzoate Openeye Name: [(1S)-1-(benzylcarbamoyl)propyl] 2-hydroxy-3-methyl-benzoate CAS Name: 2-hydroxy-3-methylbenzoic acid [(2S)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2S)-1-(benzylamino)-1-oxobutan-2-yl] 2-hydroxy-3-methylbenzoate Traditional Name: 2-hydroxy-3-methyl-benzoic acid [(1S)-1-(benzylcarbamoyl)propyl] ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=C(C(=CC=C2)C)O

Isomeric SMILES

CC[C@@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=C(C(=CC=C2)C)O

InChI

InChI=1S/C19H21NO4/c1-3-16(18(22)20-12-14-9-5-4-6-10-14)24-19(23)15-11-7-8-13(2)17(15)21/h4-11,16,21H,3,12H2,1-2H3,(H,20,22)/t16-/m0/s1