N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitro-benzamide CAS Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-nitro-benzamide Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O3S/c22-17(13-7-3-4-8-14(13)21(23)24)20-18-19-16-12-6-2-1-5-11(12)9-10-15(16)25-18/h1-8H,9-10H2,(H,19,20,22)