[2-[(3-azanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-bis(2-methylpropyl)azanium

Systemtic Name: [2-[(3-azanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-bis(2-methylpropyl)azanium Openeye Name: [2-(3-amino-4-methyl-anilino)-2-oxo-ethyl]-diisobutyl-ammonium CAS Name: [2-(3-amino-4-methylanilino)-2-oxoethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [2-(3-amino-4-methylanilino)-2-oxoethyl]-bis(2-methylpropyl)azanium Traditional Name: [2-(3-amino-4-methyl-anilino)-2-keto-ethyl]-diisobutyl-ammonium Formula: C17H30N3O+ MolecularWeight: 292.4396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+](CC(C)C)CC(C)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+](CC(C)C)CC(C)C)N

InChI

InChI=1S/C17H29N3O/c1-12(2)9-20(10-13(3)4)11-17(21)19-15-7-6-14(5)16(18)8-15/h6-8,12-13H,9-11,18H2,1-5H3,(H,19,21)/p+1