(5-bromanylthiophen-2-yl)methyl-ethyl-(3-oxidanylidene-3-phenylazanyl-propyl)azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-ethyl-(3-oxidanylidene-3-phenylazanyl-propyl)azanium Openeye Name: (3-anilino-3-oxo-propyl)-[(5-bromo-2-thienyl)methyl]-ethyl-ammonium CAS Name: (3-anilino-3-oxopropyl)-[(5-bromo-2-thiophenyl)methyl]-ethylammonium IUPAC Name: (3-anilino-3-oxopropyl)-[(5-bromothiophen-2-yl)methyl]-ethylazanium Traditional Name: (3-anilino-3-keto-propyl)-[(5-bromo-2-thienyl)methyl]-ethyl-ammonium Formula: C16H20BrN2OS+ MolecularWeight: 368.3118

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=CC=CC=C1)CC2=CC=C(S2)Br

Isomeric SMILES

CC[NH+](CCC(=O)NC1=CC=CC=C1)CC2=CC=C(S2)Br

InChI

InChI=1S/C16H19BrN2OS/c1-2-19(12-14-8-9-15(17)21-14)11-10-16(20)18-13-6-4-3-5-7-13/h3-9H,2,10-12H2,1H3,(H,18,20)/p+1