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

Systemtic Name: N-[3-(5-chloranyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]-2-methyl-3-nitro-benzamide Formula: C22H16ClN3O5 MolecularWeight: 437.83254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=C(O2)C=CC(=C3)Cl)C1=O)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C2NC3=C(O2)C=CC(=C3)Cl)C1=O)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H16ClN3O5/c1-11-8-14(24-21(28)15-4-3-5-18(12(15)2)26(29)30)10-16(20(11)27)22-25-17-9-13(23)6-7-19(17)31-22/h3-10,25H,1-2H3,(H,24,28)