1-(4-ethoxy-3-nitro-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanimine

Systemtic Name: 1-(4-ethoxy-3-nitro-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanimine Openeye Name: 1-(4-ethoxy-3-nitro-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanimine CAS Name: 1-(4-ethoxy-3-nitrophenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanimine IUPAC Name: 1-(4-ethoxy-3-nitrophenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanimine Traditional Name: (E)-(4-ethoxy-3-nitro-benzylidene)-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)amine Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=NC2=NC3=C(S2)CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=N/C2=NC3=C(S2)CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S/c1-2-22-14-8-7-11(9-13(14)19(20)21)10-17-16-18-12-5-3-4-6-15(12)23-16/h7-10H,2-6H2,1H3/b17-10+