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

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methyl-prop-2-enyl-azanium Openeye Name: allyl-[[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]methyl]ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-prop-2-enylammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methyl-prop-2-enylazanium Traditional Name: allyl-[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]ammonium Formula: C13H18ClN2O3+ MolecularWeight: 285.74662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC=C)Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC=C)Cl)OCC(=O)N

InChI

InChI=1S/C13H17ClN2O3/c1-3-4-16-7-9-5-10(14)13(11(6-9)18-2)19-8-12(15)17/h3,5-6,16H,1,4,7-8H2,2H3,(H2,15,17)/p+1