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

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4-ethoxy-3-nitro-benzamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-4-ethoxy-3-nitro-benzamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-4-ethoxy-3-nitrobenzamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-4-ethoxy-3-nitrobenzamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4-ethoxy-3-nitro-benzamide Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O4S/c1-2-27-16-9-7-13(11-15(16)23(25)26)19(24)22-20-21-18-14-6-4-3-5-12(14)8-10-17(18)28-20/h3-11H,2H2,1H3,(H,21,22,24)