2-chloranyl-N-[3-(2-methoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-(2-methoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-5-nitro-benzamide Openeye Name: 2-chloro-N-[3-(2-methoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-5-nitro-benzamide CAS Name: 2-chloro-N-[3-(2-methoxyethyl)-2-benzo[g][1,3]benzothiazolylidene]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[3-(2-methoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-5-nitrobenzamide Traditional Name: 2-chloro-N-[3-(2-methoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-5-nitro-benzamide Formula: C21H16ClN3O4S MolecularWeight: 441.88744

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

COCCN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClN3O4S/c1-29-11-10-24-18-9-6-13-4-2-3-5-15(13)19(18)30-21(24)23-20(26)16-12-14(25(27)28)7-8-17(16)22/h2-9,12H,10-11H2,1H3