N-(1,3-benzodioxol-5-yl)-3-chloranyl-N-ethyl-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-chloranyl-N-ethyl-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-chloro-N-ethyl-6-nitro-benzothiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-chloro-N-ethyl-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-chloro-N-ethyl-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-chloro-N-ethyl-6-nitro-benzothiophene-2-carboxamide Formula: C18H13ClN2O5S MolecularWeight: 404.82422

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)OCO2)C(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(C1=CC2=C(C=C1)OCO2)C(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13ClN2O5S/c1-2-20(10-4-6-13-14(7-10)26-9-25-13)18(22)17-16(19)12-5-3-11(21(23)24)8-15(12)27-17/h3-8H,2,9H2,1H3