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

Systemtic Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-5-bromanyl-2-chloranyl-benzamide Openeye Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]-5-bromo-2-chloro-benzamide CAS Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]-5-bromo-2-chlorobenzamide IUPAC Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]-5-bromo-2-chlorobenzamide Traditional Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]-5-bromo-2-chloro-benzamide Formula: C21H14BrClN2O3 MolecularWeight: 457.70446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=CC=CC=C3O2)C1=O)NC(=O)C4=C(C=CC(=C4)Br)Cl

Isomeric SMILES

CC1=CC(=CC(=C2NC3=CC=CC=C3O2)C1=O)NC(=O)C4=C(C=CC(=C4)Br)Cl

InChI

InChI=1S/C21H14BrClN2O3/c1-11-8-13(24-20(27)14-9-12(22)6-7-16(14)23)10-15(19(11)26)21-25-17-4-2-3-5-18(17)28-21/h2-10,25H,1H3,(H,24,27)