4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O4S/c24-19(13-6-8-14(9-7-13)23(25)26)22-20-21-17-11-10-16(12-18(17)28-20)27-15-4-2-1-3-5-15/h1-12H,(H,21,22,24)