[4-[(4-acetamido-3-methyl-phenyl)amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[(4-acetamido-3-methyl-phenyl)amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-(4-acetamido-3-methyl-anilino)-4-oxo-butyl]ammonium CAS Name: [4-(4-acetamido-3-methylanilino)-4-oxobutyl]ammonium IUPAC Name: [4-(4-acetamido-3-methylanilino)-4-oxobutyl]azanium Traditional Name: [4-(4-acetamido-3-methyl-anilino)-4-keto-butyl]ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C

InChI

InChI=1S/C13H19N3O2/c1-9-8-11(16-13(18)4-3-7-14)5-6-12(9)15-10(2)17/h5-6,8H,3-4,7,14H2,1-2H3,(H,15,17)(H,16,18)/p+1