N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-1-(3,3-dimethyl-2-oxidanyl-butanoyl)azetidine-2-carboxamide

Systemtic Name: N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-1-(3,3-dimethyl-2-oxidanyl-butanoyl)azetidine-2-carboxamide Openeye Name: N-[[2-(aminomethyl)-5-chloro-phenyl]methyl]-1-(2-hydroxy-3,3-dimethyl-butanoyl)azetidine-2-carboxamide CAS Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(2-hydroxy-3,3-dimethyl-1-oxobutyl)-2-azetidinecarboxamide IUPAC Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(2-hydroxy-3,3-dimethylbutanoyl)azetidine-2-carboxamide Traditional Name: N-[2-(aminomethyl)-5-chloro-benzyl]-1-(2-hydroxy-3,3-dimethyl-butanoyl)azetidine-2-carboxamide Formula: C18H26ClN3O3 MolecularWeight: 367.87034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCC1C(=O)NCC2=C(C=CC(=C2)Cl)CN)O

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCC1C(=O)NCC2=C(C=CC(=C2)Cl)CN)O

InChI

InChI=1S/C18H26ClN3O3/c1-18(2,3)15(23)17(25)22-7-6-14(22)16(24)21-10-12-8-13(19)5-4-11(12)9-20/h4-5,8,14-15,23H,6-7,9-10,20H2,1-3H3,(H,21,24)