[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl]-cyclopropyl-p-anisyl-ammonium Formula: C20H21ClN3O2+ MolecularWeight: 370.85264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC(=C(C=C2)C#N)Cl)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC(=C(C=C2)C#N)Cl)C3CC3

InChI

InChI=1S/C20H20ClN3O2/c1-26-18-8-2-14(3-9-18)12-24(17-6-7-17)13-20(25)23-16-5-4-15(11-22)19(21)10-16/h2-5,8-10,17H,6-7,12-13H2,1H3,(H,23,25)/p+1