2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenoxy]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenoxy]-1-morpholin-4-yl-ethanone Openeye Name: 2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]phenoxy]-1-morpholino-ethanone CAS Name: 2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenoxy]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]phenoxy]-1-morpholin-4-ylethanone Traditional Name: 2-[2-ethoxy-4-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]phenoxy]-1-morpholino-ethanone Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OCC(=O)N4CCOCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OCC(=O)N4CCOCC4

InChI

InChI=1S/C23H23N3O6S/c1-2-31-20-13-16(3-7-19(20)32-15-23(27)25-9-11-30-12-10-25)4-8-22-24-18-6-5-17(26(28)29)14-21(18)33-22/h3-8,13-14H,2,9-12,15H2,1H3/b8-4+