(5-chloranylthiophen-2-yl)methyl-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium CAS Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[(5-chloro-2-thiophenyl)methyl]-methylammonium IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[(5-chlorothiophen-2-yl)methyl]-methylazanium Traditional Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium Formula: C17H18ClN2O4S+ MolecularWeight: 381.85382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+](C)CC3=CC=C(S3)Cl)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+](C)CC3=CC=C(S3)Cl)OCO2

InChI

InChI=1S/C17H17ClN2O4S/c1-10(21)12-5-14-15(24-9-23-14)6-13(12)19-17(22)8-20(2)7-11-3-4-16(18)25-11/h3-6H,7-9H2,1-2H3,(H,19,22)/p+1