N-[4-chloranyl-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide

Systemtic Name: N-[4-chloranyl-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide Openeye Name: N-[4-chloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide CAS Name: N-[4-chloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide IUPAC Name: N-[4-chloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide Traditional Name: N-[4-chloro-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC=C2Cl)SC1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOCCN1C2=C(C=CC=C2Cl)SC1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN3O4S/c1-2-26-10-9-21-16-14(19)7-4-8-15(16)27-18(21)20-17(23)12-5-3-6-13(11-12)22(24)25/h3-8,11H,2,9-10H2,1H3