(2S)-2-azaniumyl-6-[(2-chlorophenyl)methoxycarbonylamino]hexanoate

Systemtic Name: (2S)-2-azaniumyl-6-[(2-chlorophenyl)methoxycarbonylamino]hexanoate Openeye Name: (2S)-2-azaniumyl-6-[(2-chlorophenyl)methoxycarbonylamino]hexanoate CAS Name: (2S)-2-ammonio-6-[[(2-chlorophenyl)methoxy-oxomethyl]amino]hexanoate IUPAC Name: (2S)-2-azaniumyl-6-[(2-chlorophenyl)methoxycarbonylamino]hexanoate Traditional Name: (2S)-2-ammonio-6-[(2-chlorobenzyl)oxycarbonylamino]hexanoate Formula: C14H19ClN2O4 MolecularWeight: 314.76466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)NCCCCC(C(=O)[O-])[NH3+])Cl

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)NCCCC[C@@H](C(=O)[O-])[NH3+])Cl

InChI

InChI=1S/C14H19ClN2O4/c15-11-6-2-1-5-10(11)9-21-14(20)17-8-4-3-7-12(16)13(18)19/h1-2,5-6,12H,3-4,7-9,16H2,(H,17,20)(H,18,19)/t12-/m0/s1