N-[4-chloranyl-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[4-chloranyl-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-(2-ketochromen-3-yl)benzamide Formula: C31H21ClN2O4 MolecularWeight: 520.96244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O)Cl)C

InChI

InChI=1S/C31H21ClN2O4/c1-17-12-18(2)28-26(13-17)34-30(38-28)24-16-22(10-11-25(24)32)33-29(35)21-8-5-7-19(14-21)23-15-20-6-3-4-9-27(20)37-31(23)36/h3-16H,1-2H3,(H,33,35)