1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethanamine

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethanamine Openeye Name: 1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethanamine CAS Name: 1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethanamine IUPAC Name: 1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethanamine Traditional Name: [1-(1,3-benzothiazol-2-yl)-2-(2-nitrophenyl)ethyl]amine Formula: C15H13N3O2S MolecularWeight: 299.34762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O2S/c16-11(9-10-5-1-3-7-13(10)18(19)20)15-17-12-6-2-4-8-14(12)21-15/h1-8,11H,9,16H2