tert-butyl N-[6-[(3-azanyl-6-chloranyl-2-oxidanyl-phenyl)carbonylamino]hexyl]carbamate

Systemtic Name: tert-butyl N-[6-[(3-azanyl-6-chloranyl-2-oxidanyl-phenyl)carbonylamino]hexyl]carbamate Openeye Name: tert-butyl N-[6-[(3-amino-6-chloro-2-hydroxy-benzoyl)amino]hexyl]carbamate CAS Name: N-[6-[[(3-amino-6-chloro-2-hydroxyphenyl)-oxomethyl]amino]hexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-[(3-amino-6-chloro-2-hydroxybenzoyl)amino]hexyl]carbamate Traditional Name: N-[6-[(3-amino-6-chloro-2-hydroxy-benzoyl)amino]hexyl]carbamic acid tert-butyl ester Formula: C18H28ClN3O4 MolecularWeight: 385.88562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCCNC(=O)C1=C(C=CC(=C1O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCCNC(=O)C1=C(C=CC(=C1O)N)Cl

InChI

InChI=1S/C18H28ClN3O4/c1-18(2,3)26-17(25)22-11-7-5-4-6-10-21-16(24)14-12(19)8-9-13(20)15(14)23/h8-9,23H,4-7,10-11,20H2,1-3H3,(H,21,24)(H,22,25)