4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N,N-dimethyl-2-nitro-aniline

Systemtic Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N,N-dimethyl-2-nitro-aniline Openeye Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-N,N-dimethyl-2-nitro-aniline CAS Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N,N-dimethyl-2-nitroaniline IUPAC Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N,N-dimethyl-2-nitroaniline Traditional Name: [4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-nitro-phenyl]-dimethyl-amine Formula: C17H15N3O2S MolecularWeight: 325.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C=CC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)/C=C/C2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O2S/c1-19(2)14-9-7-12(11-15(14)20(21)22)8-10-17-18-13-5-3-4-6-16(13)23-17/h3-11H,1-2H3/b10-8+