ethyl 2-[(4-bromophenyl)-(2-morpholin-4-ium-4-ylethanoyl)amino]ethanoate

Systemtic Name: ethyl 2-[(4-bromophenyl)-(2-morpholin-4-ium-4-ylethanoyl)amino]ethanoate Openeye Name: ethyl 2-(4-bromo-N-(2-morpholin-4-ium-4-ylacetyl)anilino)acetate CAS Name: 2-(4-bromo-N-[2-(4-morpholin-4-iumyl)-1-oxoethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-bromo-N-(2-morpholin-4-ium-4-ylacetyl)anilino)acetate Traditional Name: 2-(4-bromo-N-(2-morpholin-4-ium-4-ylacetyl)anilino)acetic acid ethyl ester Formula: C16H22BrN2O4+ MolecularWeight: 386.26088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=C(C=C1)Br)C(=O)C[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)CN(C1=CC=C(C=C1)Br)C(=O)C[NH+]2CCOCC2

InChI

InChI=1S/C16H21BrN2O4/c1-2-23-16(21)12-19(14-5-3-13(17)4-6-14)15(20)11-18-7-9-22-10-8-18/h3-6H,2,7-12H2,1H3/p+1