(5-chloranyl-2-methoxy-phenyl)methyl-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-[(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C18H28ClN2O2+ MolecularWeight: 339.88012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+](C)CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+](C)CC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H27ClN2O2/c1-13(18(22)20-16-7-5-4-6-8-16)21(2)12-14-11-15(19)9-10-17(14)23-3/h9-11,13,16H,4-8,12H2,1-3H3,(H,20,22)/p+1/t13-/m1/s1