N-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)-3,3-diphenyl-propanamide

Systemtic Name: N-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)-3,3-diphenyl-propanamide Openeye Name: N-(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)-3,3-diphenyl-propanamide CAS Name: N-(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)-3,3-diphenylpropanamide IUPAC Name: N-(4-chloro-3-methoxy-1-oxoisochromen-7-yl)-3,3-diphenylpropanamide Traditional Name: N-(4-chloro-1-keto-3-methoxy-isochromen-7-yl)-3,3-diphenyl-propionamide Formula: C25H20ClNO4 MolecularWeight: 433.8836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(C=C2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O1)Cl

Isomeric SMILES

COC1=C(C2=C(C=C(C=C2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O1)Cl

InChI

InChI=1S/C25H20ClNO4/c1-30-25-23(26)19-13-12-18(14-21(19)24(29)31-25)27-22(28)15-20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14,20H,15H2,1H3,(H,27,28)