N-benzo[e][1,3]benzothiazol-2-yl-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4,5-dimethoxy-2-nitro-benzamide Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)[N+](=O)[O-])OC

InChI

InChI=1S/C20H15N3O5S/c1-27-15-9-13(14(23(25)26)10-16(15)28-2)19(24)22-20-21-18-12-6-4-3-5-11(12)7-8-17(18)29-20/h3-10H,1-2H3,(H,21,22,24)