2-(5-chloranyl-2-methoxy-phenyl)-4-(morpholin-4-ylmethylidene)isoquinoline-1,3-dione

Systemtic Name: 2-(5-chloranyl-2-methoxy-phenyl)-4-(morpholin-4-ylmethylidene)isoquinoline-1,3-dione Openeye Name: 2-(5-chloro-2-methoxy-phenyl)-4-(morpholinomethylene)isoquinoline-1,3-dione CAS Name: 2-(5-chloro-2-methoxyphenyl)-4-(4-morpholinylmethylidene)isoquinoline-1,3-dione IUPAC Name: 2-(5-chloro-2-methoxyphenyl)-4-(morpholin-4-ylmethylidene)isoquinoline-1,3-dione Traditional Name: 2-(5-chloro-2-methoxy-phenyl)-4-(morpholinomethylene)isoquinoline-1,3-quinone Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=O)C3=CC=CC=C3C(=CN4CCOCC4)C2=O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=O)C3=CC=CC=C3C(=CN4CCOCC4)C2=O

InChI

InChI=1S/C21H19ClN2O4/c1-27-19-7-6-14(22)12-18(19)24-20(25)16-5-3-2-4-15(16)17(21(24)26)13-23-8-10-28-11-9-23/h2-7,12-13H,8-11H2,1H3