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

Systemtic Name: [2-[(3-azanyl-4-ethyl-phenyl)amino]-2-oxidanylidene-ethyl]-bis(2-methylpropyl)azanium Openeye Name: [2-(3-amino-4-ethyl-anilino)-2-oxo-ethyl]-diisobutyl-ammonium CAS Name: [2-(3-amino-4-ethylanilino)-2-oxoethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [2-(3-amino-4-ethylanilino)-2-oxoethyl]-bis(2-methylpropyl)azanium Traditional Name: [2-(3-amino-4-ethyl-anilino)-2-keto-ethyl]-diisobutyl-ammonium Formula: C18H32N3O+ MolecularWeight: 306.46618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C[NH+](CC(C)C)CC(C)C)N

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C[NH+](CC(C)C)CC(C)C)N

InChI

InChI=1S/C18H31N3O/c1-6-15-7-8-16(9-17(15)19)20-18(22)12-21(10-13(2)3)11-14(4)5/h7-9,13-14H,6,10-12,19H2,1-5H3,(H,20,22)/p+1