tert-butyl N-[8-[4-cyanobutyl(phenylmethoxy)amino]-8-oxidanylidene-octyl]-N-phenylmethoxy-carbamate

Systemtic Name: tert-butyl N-[8-[4-cyanobutyl(phenylmethoxy)amino]-8-oxidanylidene-octyl]-N-phenylmethoxy-carbamate Openeye Name: tert-butyl N-benzyloxy-N-[8-[benzyloxy(4-cyanobutyl)amino]-8-oxo-octyl]carbamate CAS Name: N-[8-[4-cyanobutyl(phenylmethoxy)amino]-8-oxooctyl]-N-phenylmethoxycarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[8-[4-cyanobutyl(phenylmethoxy)amino]-8-oxooctyl]-N-phenylmethoxycarbamate Traditional Name: N-benzoxy-N-[8-[benzoxy(4-cyanobutyl)amino]-8-keto-octyl]carbamic acid tert-butyl ester Formula: C32H45N3O5 MolecularWeight: 551.7168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCCCCC(=O)N(CCCCC#N)OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCCCCC(=O)N(CCCCC#N)OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C32H45N3O5/c1-32(2,3)40-31(37)35(39-27-29-20-12-8-13-21-29)25-16-6-4-5-14-22-30(36)34(24-17-9-15-23-33)38-26-28-18-10-7-11-19-28/h7-8,10-13,18-21H,4-6,9,14-17,22,24-27H2,1-3H3