(4-chlorophenyl)methyl-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-chlorophenyl)methyl-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (4-chlorophenyl)methyl-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]azanium Traditional Name: (4-chlorobenzyl)-[(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C13H18ClN2O+ MolecularWeight: 253.74782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH2+]CC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)[NH2+]CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H17ClN2O/c1-9(13(17)16-12-6-7-12)15-8-10-2-4-11(14)5-3-10/h2-5,9,12,15H,6-8H2,1H3,(H,16,17)/p+1/t9-/m0/s1