tert-butyl N-[5-[[2-chloranyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]amino]-5-oxidanylidene-pentyl]carbamate

Systemtic Name: tert-butyl N-[5-[[2-chloranyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]amino]-5-oxidanylidene-pentyl]carbamate Openeye Name: tert-butyl N-[5-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)anilino]-5-oxo-pentyl]carbamate CAS Name: N-[5-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)anilino]-5-oxopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)anilino]-5-oxopentyl]carbamate Traditional Name: N-[5-[2-chloro-5-(4-keto-3H-phthalazin-1-yl)anilino]-5-keto-pentyl]carbamic acid tert-butyl ester Formula: C24H27ClN4O4 MolecularWeight: 470.94858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(=O)NC1=C(C=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC(=O)NC1=C(C=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C24H27ClN4O4/c1-24(2,3)33-23(32)26-13-7-6-10-20(30)27-19-14-15(11-12-18(19)25)21-16-8-4-5-9-17(16)22(31)29-28-21/h4-5,8-9,11-12,14H,6-7,10,13H2,1-3H3,(H,26,32)(H,27,30)(H,29,31)