[4-(methylcarbamoyl)phenyl]methyl-[(2S,3S)-3-methylpentan-2-yl]azanium

Systemtic Name: [4-(methylcarbamoyl)phenyl]methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Openeye Name: [(1S,2S)-1,2-dimethylbutyl]-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: [4-(methylcarbamoyl)phenyl]methyl-[(2S,3S)-3-methylpentan-2-yl]ammonium IUPAC Name: [4-(methylcarbamoyl)phenyl]methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Traditional Name: [(1S,2S)-1,2-dimethylbutyl]-[4-(methylcarbamoyl)benzyl]ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)[NH2+]CC1=CC=C(C=C1)C(=O)NC

Isomeric SMILES

CC[C@H](C)[C@H](C)[NH2+]CC1=CC=C(C=C1)C(=O)NC

InChI

InChI=1S/C15H24N2O/c1-5-11(2)12(3)17-10-13-6-8-14(9-7-13)15(18)16-4/h6-9,11-12,17H,5,10H2,1-4H3,(H,16,18)/p+1/t11-,12-/m0/s1