[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]-ethyl-azanium

Systemtic Name: [2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]-ethyl-azanium Openeye Name: [2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-[(4-ethoxy-3-methoxy-phenyl)methyl]-ethyl-ammonium CAS Name: [2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-[(4-ethoxy-3-methoxyphenyl)methyl]-ethylammonium IUPAC Name: [2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-[(4-ethoxy-3-methoxyphenyl)methyl]-ethylazanium Traditional Name: [2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-(4-ethoxy-3-methoxy-benzyl)-ethyl-ammonium Formula: C21H28ClN2O4+ MolecularWeight: 407.91102

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC(=O)NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC(=O)NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C21H27ClN2O4/c1-5-24(13-15-7-9-19(28-6-2)20(11-15)27-4)14-21(25)23-17-12-16(22)8-10-18(17)26-3/h7-12H,5-6,13-14H2,1-4H3,(H,23,25)/p+1