[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-3-methyl-benzoate

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-3-methyl-benzoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-amino-3-methyl-benzoate CAS Name: 2-amino-3-methylbenzoic acid [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] 2-amino-3-methylbenzoate Traditional Name: 2-amino-3-methyl-benzoic acid [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N)C(=O)OC(C)C(=O)NC2CCCCC2

Isomeric SMILES

CC1=CC=CC(=C1N)C(=O)O[C@@H](C)C(=O)NC2CCCCC2

InChI

InChI=1S/C17H24N2O3/c1-11-7-6-10-14(15(11)18)17(21)22-12(2)16(20)19-13-8-4-3-5-9-13/h6-7,10,12-13H,3-5,8-9,18H2,1-2H3,(H,19,20)/t12-/m0/s1