tert-butyl N-[1-oxidanylidene-3-(4-phenylmethoxyphenyl)-1-(2-phthalazin-1-ylhydrazinyl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-3-(4-phenylmethoxyphenyl)-1-(2-phthalazin-1-ylhydrazinyl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(4-benzyloxyphenyl)methyl]-2-oxo-2-(2-phthalazin-1-ylhydrazino)ethyl]carbamate CAS Name: N-[1-oxo-3-(4-phenylmethoxyphenyl)-1-(1-phthalazinylhydrazo)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-oxo-3-(4-phenylmethoxyphenyl)-1-(2-phthalazin-1-ylhydrazinyl)propan-2-yl]carbamate Traditional Name: N-[1-(4-benzoxybenzyl)-2-keto-2-(N'-phthalazin-1-ylhydrazino)ethyl]carbamic acid tert-butyl ester Formula: C29H31N5O4 MolecularWeight: 513.58754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NNC3=NN=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NNC3=NN=CC4=CC=CC=C43

InChI

InChI=1S/C29H31N5O4/c1-29(2,3)38-28(36)31-25(27(35)34-33-26-24-12-8-7-11-22(24)18-30-32-26)17-20-13-15-23(16-14-20)37-19-21-9-5-4-6-10-21/h4-16,18,25H,17,19H2,1-3H3,(H,31,36)(H,32,33)(H,34,35)