(3-chlorophenyl)methyl-[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (3-chlorophenyl)methyl-[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (3-chlorophenyl)methyl-[(1R)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-chlorophenyl)methyl-[(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (3-chlorophenyl)methyl-[(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (3-chlorobenzyl)-[(1R)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C18H28ClN2O+ MolecularWeight: 323.88072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)[NH+](C)CC2=CC(=CC=C2)Cl

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)[NH+](C)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H27ClN2O/c1-14(18(22)20-12-15-7-4-3-5-8-15)21(2)13-16-9-6-10-17(19)11-16/h6,9-11,14-15H,3-5,7-8,12-13H2,1-2H3,(H,20,22)/p+1/t14-/m1/s1