(E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3,4-diethoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acrylamide Formula: C20H19N3O5S MolecularWeight: 413.44696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OCC

InChI

InChI=1S/C20H19N3O5S/c1-3-27-16-9-5-13(11-17(16)28-4-2)6-10-19(24)22-20-21-15-8-7-14(23(25)26)12-18(15)29-20/h5-12H,3-4H2,1-2H3,(H,21,22,24)/b10-6+