(5-chloranylthiophen-2-yl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-methyl-azanium Openeye Name: (5-chloro-2-thienyl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxo-propyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-methylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-methylazanium Traditional Name: (5-chloro-2-thienyl)methyl-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-keto-propyl]-methyl-ammonium Formula: C17H20ClN2O3S+ MolecularWeight: 367.8703

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=CC2=C(C=C1)OCCO2)CC3=CC=C(S3)Cl

Isomeric SMILES

C[NH+](CCC(=O)NC1=CC2=C(C=C1)OCCO2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C17H19ClN2O3S/c1-20(11-13-3-5-16(18)24-13)7-6-17(21)19-12-2-4-14-15(10-12)23-9-8-22-14/h2-5,10H,6-9,11H2,1H3,(H,19,21)/p+1