5-chloranyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide Openeye Name: 5-chloro-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide CAS Name: 5-chloro-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide IUPAC Name: 5-chloro-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide Traditional Name: 5-chloro-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide Formula: C17H14ClN3O4S MolecularWeight: 391.82876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])N2C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])N2C

InChI

InChI=1S/C17H14ClN3O4S/c1-3-25-13-5-4-6-14-15(13)20(2)17(26-14)19-16(22)11-9-10(18)7-8-12(11)21(23)24/h4-9H,3H2,1-2H3