[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methyl-(2-methoxyethyl)azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methyl-(2-methoxyethyl)azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]methyl-(2-methoxyethyl)ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-(2-methoxyethyl)azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]-(2-methoxyethyl)ammonium Formula: C13H20ClN2O4+ MolecularWeight: 303.7619

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC(=O)N)OC

Isomeric SMILES

COCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC(=O)N)OC

InChI

InChI=1S/C13H19ClN2O4/c1-18-4-3-16-7-9-5-10(14)13(11(6-9)19-2)20-8-12(15)17/h5-6,16H,3-4,7-8H2,1-2H3,(H2,15,17)/p+1