[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-methyl-2-morpholin-4-ium-4-yl-propyl)azanium

Systemtic Name: [2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-methyl-2-morpholin-4-ium-4-yl-propyl)azanium Openeye Name: [2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl]-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ammonium CAS Name: [2-(2-chloro-4-methylanilino)-2-oxoethyl]-[2-methyl-2-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [2-(2-chloro-4-methylanilino)-2-oxoethyl]-(2-methyl-2-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [2-(2-chloro-4-methyl-anilino)-2-keto-ethyl]-(2-methyl-2-morpholin-4-ium-4-yl-propyl)ammonium Formula: C17H28ClN3O2+2 MolecularWeight: 341.87612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26ClN3O2/c1-13-4-5-15(14(18)10-13)20-16(22)11-19-12-17(2,3)21-6-8-23-9-7-21/h4-5,10,19H,6-9,11-12H2,1-3H3,(H,20,22)/p+2