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

Systemtic Name: N-[3-(2-ethoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-3-nitro-benzamide Openeye Name: N-[3-(2-ethoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-3-nitro-benzamide CAS Name: N-[3-(2-ethoxyethyl)-2-benzo[g][1,3]benzothiazolylidene]-3-nitrobenzamide IUPAC Name: N-[3-(2-ethoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-3-nitrobenzamide Traditional Name: N-[3-(2-ethoxyethyl)benzo[g][1,3]benzothiazol-2-ylidene]-3-nitro-benzamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOCCN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-2-29-13-12-24-19-11-10-15-6-3-4-9-18(15)20(19)30-22(24)23-21(26)16-7-5-8-17(14-16)25(27)28/h3-11,14H,2,12-13H2,1H3