(3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(2-diethylaminoethyl)azanium

Systemtic Name: (3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(2-diethylaminoethyl)azanium Openeye Name: (4-allyloxy-3-chloro-5-methoxy-phenyl)methyl-(2-diethylaminoethyl)ammonium CAS Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2-diethylaminoethyl)ammonium IUPAC Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2-diethylaminoethyl)azanium Traditional Name: (4-allyloxy-3-chloro-5-methoxy-benzyl)-(2-diethylaminoethyl)ammonium Formula: C17H28ClN2O2+ MolecularWeight: 327.86942

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC=C)OC

Isomeric SMILES

CCN(CC)CC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC=C)OC

InChI

InChI=1S/C17H27ClN2O2/c1-5-10-22-17-15(18)11-14(12-16(17)21-4)13-19-8-9-20(6-2)7-3/h5,11-12,19H,1,6-10,13H2,2-4H3/p+1