[3-(3-methylbutanoylamino)phenyl]methylazanium

Systemtic Name: [3-(3-methylbutanoylamino)phenyl]methylazanium Openeye Name: [3-(3-methylbutanoylamino)phenyl]methylammonium CAS Name: [3-[(3-methyl-1-oxobutyl)amino]phenyl]methylammonium IUPAC Name: [3-(3-methylbutanoylamino)phenyl]methylazanium Traditional Name: [3-(isovalerylamino)benzyl]ammonium Formula: C12H19N2O+ MolecularWeight: 207.29206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O/c1-9(2)6-12(15)14-11-5-3-4-10(7-11)8-13/h3-5,7,9H,6,8,13H2,1-2H3,(H,14,15)/p+1