[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [2-(2,6-dimethylanilino)-2-keto-ethyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C17H29N3O2+2 MolecularWeight: 307.43106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH2+]CCC[NH+]2CCOCC2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH2+]CCC[NH+]2CCOCC2

InChI

InChI=1S/C17H27N3O2/c1-14-5-3-6-15(2)17(14)19-16(21)13-18-7-4-8-20-9-11-22-12-10-20/h3,5-6,18H,4,7-13H2,1-2H3,(H,19,21)/p+2