4-[2,4-bis(chloranyl)phenoxy]-N-[(6-methoxy-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(6-methoxy-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[(6-methoxy-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[(6-methoxy-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[(6-methoxy-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[(1-keto-6-methoxy-2-methyl-4-phenyl-3-isoquinolyl)methyl]butyramide Formula: C28H26Cl2N2O4 MolecularWeight: 525.42304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)CNC(=O)CCCOC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)CNC(=O)CCCOC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H26Cl2N2O4/c1-32-24(17-31-26(33)9-6-14-36-25-13-10-19(29)15-23(25)30)27(18-7-4-3-5-8-18)22-16-20(35-2)11-12-21(22)28(32)34/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3,(H,31,33)