N-benzo[e][1,3]benzothiazol-2-yl-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4-chloranyl-3-nitro-benzamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-4-chloro-3-nitro-benzamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-4-chloro-3-nitrobenzamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-4-chloro-3-nitrobenzamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4-chloro-3-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=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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