2-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]ethylazanium

Systemtic Name: 2-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]ethylazanium Openeye Name: 2-[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]ethylammonium CAS Name: 2-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]ethylammonium IUPAC Name: 2-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]ethylazanium Traditional Name: 2-[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-phenyl]ethylammonium Formula: C11H16ClN2O3+ MolecularWeight: 259.70934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC[NH3+])Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)CC[NH3+])Cl)OCC(=O)N

InChI

InChI=1S/C11H15ClN2O3/c1-16-9-5-7(2-3-13)4-8(12)11(9)17-6-10(14)15/h4-5H,2-3,6,13H2,1H3,(H2,14,15)/p+1