2-[(E)-2-(4-methoxy-3-methyl-phenyl)ethenyl]-5-nitro-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(4-methoxy-3-methyl-phenyl)ethenyl]-5-nitro-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4-methoxy-3-methyl-phenyl)vinyl]-5-nitro-1,3-benzothiazole CAS Name: 2-[(E)-2-(4-methoxy-3-methylphenyl)ethenyl]-5-nitro-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(4-methoxy-3-methylphenyl)ethenyl]-5-nitro-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4-methoxy-3-methyl-phenyl)vinyl]-5-nitro-1,3-benzothiazole Formula: C17H14N2O3S MolecularWeight: 326.36966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=CC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC(=C1)/C=C/C2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H14N2O3S/c1-11-9-12(3-6-15(11)22-2)4-8-17-18-14-10-13(19(20)21)5-7-16(14)23-17/h3-10H,1-2H3/b8-4+