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

Systemtic Name: 2-chloranyl-5-iodanyl-N-[(3E)-5-methyl-4-oxidanylidene-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]benzamide Openeye Name: 2-chloro-5-iodo-N-[(3E)-3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]benzamide CAS Name: 2-chloro-5-iodo-N-[(3E)-5-methyl-4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-1,5-dienyl]benzamide IUPAC Name: 2-chloro-5-iodo-N-[(3E)-5-methyl-4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]benzamide Traditional Name: 2-chloro-5-iodo-N-[(3E)-3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]benzamide Formula: C24H20ClIN2O3 MolecularWeight: 546.78467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=C(O2)C=CC(=C3)C(C)C)C1=O)NC(=O)C4=C(C=CC(=C4)I)Cl

Isomeric SMILES

CC1=CC(=C/C(=C\2/NC3=C(O2)C=CC(=C3)C(C)C)/C1=O)NC(=O)C4=C(C=CC(=C4)I)Cl

InChI

InChI=1S/C24H20ClIN2O3/c1-12(2)14-4-7-21-20(9-14)28-24(31-21)18-11-16(8-13(3)22(18)29)27-23(30)17-10-15(26)5-6-19(17)25/h4-12,28H,1-3H3,(H,27,30)/b24-18+