3-(4-ethoxy-3-methoxy-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-ethoxy-3-methoxy-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-ethoxy-3-methoxy-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-ethoxy-3-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-ethoxy-3-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-ethoxy-3-methoxy-phenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19N3O5S/c1-3-27-15-8-4-12(10-16(15)26-2)5-9-18(23)21-19-20-14-7-6-13(22(24)25)11-17(14)28-19/h4,6-8,10-11H,3,5,9H2,1-2H3,(H,20,21,23)