[2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [2-(3-bromo-4-methyl-anilino)-2-oxo-ethyl]-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [2-(3-bromo-4-methyl-anilino)-2-keto-ethyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C15H24BrN3O2+2 MolecularWeight: 358.27396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22BrN3O2/c1-12-2-3-13(10-14(12)16)18-15(20)11-17-4-5-19-6-8-21-9-7-19/h2-3,10,17H,4-9,11H2,1H3,(H,18,20)/p+2