[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-[(5-bromanylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-[(5-bromo-2-thienyl)methyl]-methyl-ammonium CAS Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-[(5-bromo-2-thiophenyl)methyl]-methylammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-[(5-bromothiophen-2-yl)methyl]-methylazanium Traditional Name: [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-[(5-bromo-2-thienyl)methyl]-methyl-ammonium Formula: C15H16BrN2O3S+ MolecularWeight: 384.26814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15BrN2O3S/c1-18(7-11-3-5-14(16)22-11)8-15(19)17-10-2-4-12-13(6-10)21-9-20-12/h2-6H,7-9H2,1H3,(H,17,19)/p+1