ethyl 4-[[6-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]-methyl-amino]butanoate

Systemtic Name: ethyl 4-[[6-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]-methyl-amino]butanoate Openeye Name: ethyl 4-[[6-chloro-4-[(3-chloro-4-methoxy-phenyl)methylamino]phthalazin-1-yl]-methyl-amino]butanoate CAS Name: 4-[[6-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]-1-phthalazinyl]-methylamino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[6-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]phthalazin-1-yl]-methylamino]butanoate Traditional Name: 4-[[6-chloro-4-[(3-chloro-4-methoxy-benzyl)amino]phthalazin-1-yl]-methyl-amino]butyric acid ethyl ester Formula: C23H26Cl2N4O3 MolecularWeight: 477.38354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(C)C1=NN=C(C2=C1C=CC(=C2)Cl)NCC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCOC(=O)CCCN(C)C1=NN=C(C2=C1C=CC(=C2)Cl)NCC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C23H26Cl2N4O3/c1-4-32-21(30)6-5-11-29(2)23-17-9-8-16(24)13-18(17)22(27-28-23)26-14-15-7-10-20(31-3)19(25)12-15/h7-10,12-13H,4-6,11,14H2,1-3H3,(H,26,27)