N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitro-furan-2-carboxamide Openeye Name: N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitro-furan-2-carboxamide CAS Name: N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitro-2-furancarboxamide IUPAC Name: N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitrofuran-2-carboxamide Traditional Name: N-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-5-nitro-2-furamide Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC3=C2N=C(S3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2N=C(S3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])C=C1

InChI

InChI=1S/C17H13N3O5S/c1-24-10-4-2-9-3-6-13-15(11(9)8-10)18-17(26-13)19-16(21)12-5-7-14(25-12)20(22)23/h2,4-5,7-8H,3,6H2,1H3,(H,18,19,21)