(3S)-3-(4-bromophenyl)-3,5,5-trimethyl-morpholin-4-ium

Systemtic Name: (3S)-3-(4-bromophenyl)-3,5,5-trimethyl-morpholin-4-ium Openeye Name: (3S)-3-(4-bromophenyl)-3,5,5-trimethyl-morpholin-4-ium CAS Name: (3S)-3-(4-bromophenyl)-3,5,5-trimethylmorpholin-4-ium IUPAC Name: (3S)-3-(4-bromophenyl)-3,5,5-trimethylmorpholin-4-ium Traditional Name: (3S)-3-(4-bromophenyl)-3,5,5-trimethyl-morpholin-4-ium Formula: C13H19BrNO+ MolecularWeight: 285.20006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCC([NH2+]1)(C)C2=CC=C(C=C2)Br)C

Isomeric SMILES

C[C@@]1(COCC([NH2+]1)(C)C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H18BrNO/c1-12(2)8-16-9-13(3,15-12)10-4-6-11(14)7-5-10/h4-7,15H,8-9H2,1-3H3/p+1/t13-/m1/s1