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

Systemtic Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)ethenyl]-5-methyl-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]-5-methyl-1,3-benzothiazole CAS Name: 2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-5-methyl-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-5-methyl-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]-5-methyl-1,3-benzothiazole Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)C=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)/C=C/C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H16N2O4S/c1-11-4-6-17-13(8-11)19-18(25-17)7-5-12-9-15(23-2)16(24-3)10-14(12)20(21)22/h4-10H,1-3H3/b7-5+