[(2S,3R)-1-[(4-ethoxyphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3R)-1-[(4-ethoxyphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2R)-1-[(4-ethoxyphenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3R)-1-(4-ethoxyanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3R)-1-(4-ethoxyanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2R)-2-methyl-1-(p-phenetylcarbamoyl)butyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)OCC)[NH3+]

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)NC1=CC=C(C=C1)OCC)[NH3+]

InChI

InChI=1S/C14H22N2O2/c1-4-10(3)13(15)14(17)16-11-6-8-12(9-7-11)18-5-2/h6-10,13H,4-5,15H2,1-3H3,(H,16,17)/p+1/t10-,13+/m1/s1