N-benzo[e][1,3]benzothiazol-2-yl-5-chloranyl-2-nitro-benzamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-5-chloranyl-2-nitro-benzamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-5-chloro-2-nitro-benzamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-5-chloro-2-nitrobenzamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-5-chloro-2-nitrobenzamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-5-chloro-2-nitro-benzamide Formula: C18H10ClN3O3S MolecularWeight: 383.8083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H10ClN3O3S/c19-11-6-7-14(22(24)25)13(9-11)17(23)21-18-20-16-12-4-2-1-3-10(12)5-8-15(16)26-18/h1-9H,(H,20,21,23)