(5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[2-keto-2-[2-(3-methylphenoxy)ethylamino]ethyl]-methyl-ammonium Formula: C20H26ClN2O3+ MolecularWeight: 377.88504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C[NH+](C)CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C[NH+](C)CC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C20H25ClN2O3/c1-15-5-4-6-18(11-15)26-10-9-22-20(24)14-23(2)13-16-12-17(21)7-8-19(16)25-3/h4-8,11-12H,9-10,13-14H2,1-3H3,(H,22,24)/p+1