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

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-2-phenoxy-propanamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-2-phenoxy-propanamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-2-phenoxypropanamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-2-phenoxypropanamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-methyl-2-phenoxy-propionamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O5S/c1-18(2,26-12-7-5-4-6-8-12)16(22)20-17-19-15-13(25-3)9-11(21(23)24)10-14(15)27-17/h4-10H,1-3H3,(H,19,20,22)