tert-butyl N-(4-cyanophenyl)sulfonyl-N-(phenylmethoxycarbonylamino)carbamate

Systemtic Name: tert-butyl N-(4-cyanophenyl)sulfonyl-N-(phenylmethoxycarbonylamino)carbamate Openeye Name: tert-butyl N-(benzyloxycarbonylamino)-N-(4-cyanophenyl)sulfonyl-carbamate CAS Name: N-(4-cyanophenyl)sulfonyl-N-(phenylmethoxycarbonylamino)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(4-cyanophenyl)sulfonyl-N-(phenylmethoxycarbonylamino)carbamate Traditional Name: N-(benzyloxycarbonylamino)-N-(4-cyanophenyl)sulfonyl-carbamic acid tert-butyl ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(NC(=O)OCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N(NC(=O)OCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H21N3O6S/c1-20(2,3)29-19(25)23(22-18(24)28-14-16-7-5-4-6-8-16)30(26,27)17-11-9-15(13-21)10-12-17/h4-12H,14H2,1-3H3,(H,22,24)