tert-butyl N-[[4-(acetamidomethyl)phenyl]methyl-(cyclopentylcarbamoyl)amino]carbamate

Systemtic Name: tert-butyl N-[[4-(acetamidomethyl)phenyl]methyl-(cyclopentylcarbamoyl)amino]carbamate Openeye Name: tert-butyl N-[[4-(acetamidomethyl)phenyl]methyl-(cyclopentylcarbamoyl)amino]carbamate CAS Name: N-[[4-(acetamidomethyl)phenyl]methyl-[(cyclopentylamino)-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(acetamidomethyl)phenyl]methyl-(cyclopentylcarbamoyl)amino]carbamate Traditional Name: N-[[4-(acetamidomethyl)benzyl]-(cyclopentylcarbamoyl)amino]carbamic acid tert-butyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)CN(C(=O)NC2CCCC2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)CN(C(=O)NC2CCCC2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N4O4/c1-15(26)22-13-16-9-11-17(12-10-16)14-25(24-20(28)29-21(2,3)4)19(27)23-18-7-5-6-8-18/h9-12,18H,5-8,13-14H2,1-4H3,(H,22,26)(H,23,27)(H,24,28)