[2-[[5-(2-chloranylethanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[5-(2-chloranylethanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[5-[(2-chloroacetyl)amino]-2-methyl-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[5-[(2-chloro-1-oxoethyl)amino]-2-methylanilino]-2-oxoethyl]ammonium IUPAC Name: [2-[5-[(2-chloroacetyl)amino]-2-methylanilino]-2-oxoethyl]azanium Traditional Name: [2-[5-[(2-chloroacetyl)amino]-2-methyl-anilino]-2-keto-ethyl]ammonium Formula: C11H15ClN3O2+ MolecularWeight: 256.7087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14ClN3O2/c1-7-2-3-8(14-10(16)5-12)4-9(7)15-11(17)6-13/h2-4H,5-6,13H2,1H3,(H,14,16)(H,15,17)/p+1