tert-butyl N-[4-[[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]carbamoyl]cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-[[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]carbamoyl]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]carbamoyl]cyclohexyl]carbamate CAS Name: N-[4-[oxo-[3-(4-oxo-3H-phthalazin-1-yl)anilino]methyl]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]carbamoyl]cyclohexyl]carbamate Traditional Name: N-[4-[[3-(4-keto-3H-phthalazin-1-yl)phenyl]carbamoyl]cyclohexyl]carbamic acid tert-butyl ester Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C26H30N4O4/c1-26(2,3)34-25(33)28-18-13-11-16(12-14-18)23(31)27-19-8-6-7-17(15-19)22-20-9-4-5-10-21(20)24(32)30-29-22/h4-10,15-16,18H,11-14H2,1-3H3,(H,27,31)(H,28,33)(H,30,32)