[2-[(2-azanyl-4-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-propan-2-yl-azanium

Systemtic Name: [2-[(2-azanyl-4-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-propan-2-yl-azanium Openeye Name: [2-(2-amino-4-chloro-anilino)-2-oxo-ethyl]-isopropyl-methyl-ammonium CAS Name: [2-(2-amino-4-chloroanilino)-2-oxoethyl]-methyl-propan-2-ylammonium IUPAC Name: [2-(2-amino-4-chloroanilino)-2-oxoethyl]-methyl-propan-2-ylazanium Traditional Name: [2-(2-amino-4-chloro-anilino)-2-keto-ethyl]-isopropyl-methyl-ammonium Formula: C12H19ClN3O+ MolecularWeight: 256.75176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)CC(=O)NC1=C(C=C(C=C1)Cl)N

Isomeric SMILES

CC(C)[NH+](C)CC(=O)NC1=C(C=C(C=C1)Cl)N

InChI

InChI=1S/C12H18ClN3O/c1-8(2)16(3)7-12(17)15-11-5-4-9(13)6-10(11)14/h4-6,8H,7,14H2,1-3H3,(H,15,17)/p+1