[5-[(Z)-N-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-azanium

Systemtic Name: [5-[(Z)-N-[(5-chloranyl-2-oxidanyl-phenyl)carbonylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-azanium Openeye Name: [5-[(Z)-N-[(5-chloro-2-hydroxy-benzoyl)amino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-ammonium CAS Name: [5-[(1Z)-1-[[(5-chloro-2-hydroxyphenyl)-oxomethyl]hydrazinylidene]ethyl]-2-methoxyphenyl]methyl-diethylammonium IUPAC Name: [5-[(Z)-N-[(5-chloro-2-hydroxybenzoyl)amino]-C-methylcarbonimidoyl]-2-methoxyphenyl]methyl-diethylazanium Traditional Name: [5-[(Z)-N-[(5-chloro-2-hydroxy-benzoyl)amino]-C-methyl-carbonimidoyl]-2-methoxy-benzyl]-diethyl-ammonium Formula: C21H27ClN3O3+ MolecularWeight: 404.91038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)/C(=N\NC(=O)C2=C(C=CC(=C2)Cl)O)/C)OC

InChI

InChI=1S/C21H26ClN3O3/c1-5-25(6-2)13-16-11-15(7-10-20(16)28-4)14(3)23-24-21(27)18-12-17(22)8-9-19(18)26/h7-12,26H,5-6,13H2,1-4H3,(H,24,27)/p+1/b23-14-