2-(4-chloranylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-propanamide Openeye Name: 2-(4-chlorophenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-propanamide CAS Name: 2-(4-chlorophenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methylpropanamide IUPAC Name: 2-(4-chlorophenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methylpropanamide Traditional Name: 2-(4-chlorophenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-propionamide Formula: C18H16ClN3O5S MolecularWeight: 421.85474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=NC2=C(C=C(C=C2S1)[N+](=O)[O-])OC)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=NC2=C(C=C(C=C2S1)[N+](=O)[O-])OC)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O5S/c1-18(2,27-12-6-4-10(19)5-7-12)16(23)21-17-20-15-13(26-3)8-11(22(24)25)9-14(15)28-17/h4-9H,1-3H3,(H,20,21,23)