tert-butyl N-[2-[8-(2-chloranylethanoylamino)-5-ethyl-5-methanoyl-2-oxidanylidene-octyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-[8-(2-chloranylethanoylamino)-5-ethyl-5-methanoyl-2-oxidanylidene-octyl]phenyl]carbamate Openeye Name: tert-butyl N-[2-[8-[(2-chloroacetyl)amino]-5-ethyl-5-formyl-2-oxo-octyl]phenyl]carbamate CAS Name: N-[2-[8-[(2-chloro-1-oxoethyl)amino]-5-ethyl-5-formyl-2-oxooctyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[8-[(2-chloroacetyl)amino]-5-ethyl-5-formyl-2-oxooctyl]phenyl]carbamate Traditional Name: N-[2-[8-[(2-chloroacetyl)amino]-5-ethyl-5-formyl-2-keto-octyl]phenyl]carbamic acid tert-butyl ester Formula: C24H35ClN2O5 MolecularWeight: 466.9981

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCNC(=O)CCl)(CCC(=O)CC1=CC=CC=C1NC(=O)OC(C)(C)C)C=O

Isomeric SMILES

CCC(CCCNC(=O)CCl)(CCC(=O)CC1=CC=CC=C1NC(=O)OC(C)(C)C)C=O

InChI

InChI=1S/C24H35ClN2O5/c1-5-24(17-28,12-8-14-26-21(30)16-25)13-11-19(29)15-18-9-6-7-10-20(18)27-22(31)32-23(2,3)4/h6-7,9-10,17H,5,8,11-16H2,1-4H3,(H,26,30)(H,27,31)