2-[[5-[(2-chloranyl-4-methoxy-phenoxy)methyl]-1,2-oxazol-3-yl]carbonyl-methyl-amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[5-[(2-chloranyl-4-methoxy-phenoxy)methyl]-1,2-oxazol-3-yl]carbonyl-methyl-amino]ethyl-diethyl-azanium Openeye Name: 2-[[5-[(2-chloro-4-methoxy-phenoxy)methyl]isoxazole-3-carbonyl]-methyl-amino]ethyl-diethyl-ammonium CAS Name: 2-[[[5-[(2-chloro-4-methoxyphenoxy)methyl]-3-isoxazolyl]-oxomethyl]-methylamino]ethyl-diethylammonium IUPAC Name: 2-[[5-[(2-chloro-4-methoxyphenoxy)methyl]-1,2-oxazole-3-carbonyl]-methylamino]ethyl-diethylazanium Traditional Name: 2-[[5-[(2-chloro-4-methoxy-phenoxy)methyl]isoxazole-3-carbonyl]-methyl-amino]ethyl-diethyl-ammonium Formula: C19H27ClN3O4+ MolecularWeight: 396.88838

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C)C(=O)C1=NOC(=C1)COC2=C(C=C(C=C2)OC)Cl

Isomeric SMILES

CC[NH+](CC)CCN(C)C(=O)C1=NOC(=C1)COC2=C(C=C(C=C2)OC)Cl

InChI

InChI=1S/C19H26ClN3O4/c1-5-23(6-2)10-9-22(3)19(24)17-12-15(27-21-17)13-26-18-8-7-14(25-4)11-16(18)20/h7-8,11-12H,5-6,9-10,13H2,1-4H3/p+1