(phenylmethyl) N-(2-cyanoethyl)-N-[4-(phenylmethoxycarbonylamino)butyl]carbamate

Systemtic Name: (phenylmethyl) N-(2-cyanoethyl)-N-[4-(phenylmethoxycarbonylamino)butyl]carbamate Openeye Name: benzyl N-[4-(benzyloxycarbonylamino)butyl]-N-(2-cyanoethyl)carbamate CAS Name: N-(2-cyanoethyl)-N-[4-(phenylmethoxycarbonylamino)butyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-cyanoethyl)-N-[4-(phenylmethoxycarbonylamino)butyl]carbamate Traditional Name: N-[4-(benzyloxycarbonylamino)butyl]-N-(2-cyanoethyl)carbamic acid benzyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCN(CCC#N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCN(CCC#N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H27N3O4/c24-14-9-17-26(23(28)30-19-21-12-5-2-6-13-21)16-8-7-15-25-22(27)29-18-20-10-3-1-4-11-20/h1-6,10-13H,7-9,15-19H2,(H,25,27)