N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-5-chloranyl-2-nitro-benzamide

Systemtic Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-5-chloranyl-2-nitro-benzamide Openeye Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-5-chloro-2-nitro-benzamide CAS Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-5-chloro-2-nitrobenzamide IUPAC Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-5-chloro-2-nitrobenzamide Traditional Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-5-chloro-2-nitro-benzamide Formula: C20H12ClN3O4S MolecularWeight: 425.84498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C/3\C=C(C=CC3=O)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])/S2

InChI

InChI=1S/C20H12ClN3O4S/c21-11-5-7-16(24(27)28)13(9-11)19(26)22-12-6-8-17(25)14(10-12)20-23-15-3-1-2-4-18(15)29-20/h1-10,23H,(H,22,26)/b20-14-