[(2S,3S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(2-methoxyphenyl)methylcarbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-(o-anisylcarbamoyl)butyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=CC=CC=C1OC)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCC1=CC=CC=C1OC)[NH3+]

InChI

InChI=1S/C14H22N2O2/c1-4-10(2)13(15)14(17)16-9-11-7-5-6-8-12(11)18-3/h5-8,10,13H,4,9,15H2,1-3H3,(H,16,17)/p+1/t10-,13-/m0/s1