[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl]-methyl-[(2-morpholinophenyl)methyl]ammonium CAS Name: [2-(3-cyanoanilino)-2-oxoethyl]-methyl-[[2-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Traditional Name: [2-(3-cyanoanilino)-2-keto-ethyl]-methyl-(2-morpholinobenzyl)ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H24N4O2/c1-24(16-21(26)23-19-7-4-5-17(13-19)14-22)15-18-6-2-3-8-20(18)25-9-11-27-12-10-25/h2-8,13H,9-12,15-16H2,1H3,(H,23,26)/p+1