[4-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-(2-chloro-5-methoxycarbonyl-anilino)-4-oxo-butyl]ammonium CAS Name: [4-(2-chloro-5-methoxycarbonylanilino)-4-oxobutyl]ammonium IUPAC Name: [4-(2-chloro-5-methoxycarbonylanilino)-4-oxobutyl]azanium Traditional Name: [4-(5-carbomethoxy-2-chloro-anilino)-4-keto-butyl]ammonium Formula: C12H16ClN2O3+ MolecularWeight: 271.72004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O3/c1-18-12(17)8-4-5-9(13)10(7-8)15-11(16)3-2-6-14/h4-5,7H,2-3,6,14H2,1H3,(H,15,16)/p+1