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

Systemtic Name: N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-1-(3-cyclopropyl-3-methyl-2-oxidanyl-butanoyl)azetidine-2-carboxamide Openeye Name: N-[[2-(aminomethyl)-5-chloro-phenyl]methyl]-1-(3-cyclopropyl-2-hydroxy-3-methyl-butanoyl)azetidine-2-carboxamide CAS Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(3-cyclopropyl-2-hydroxy-3-methyl-1-oxobutyl)-2-azetidinecarboxamide IUPAC Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(3-cyclopropyl-2-hydroxy-3-methylbutanoyl)azetidine-2-carboxamide Traditional Name: N-[2-(aminomethyl)-5-chloro-benzyl]-1-(3-cyclopropyl-2-hydroxy-3-methyl-butanoyl)azetidine-2-carboxamide Formula: C20H28ClN3O3 MolecularWeight: 393.90762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC1)C(C(=O)N2CCC2C(=O)NCC3=C(C=CC(=C3)Cl)CN)O

Isomeric SMILES

CC(C)(C1CC1)C(C(=O)N2CCC2C(=O)NCC3=C(C=CC(=C3)Cl)CN)O

InChI

InChI=1S/C20H28ClN3O3/c1-20(2,14-4-5-14)17(25)19(27)24-8-7-16(24)18(26)23-11-13-9-15(21)6-3-12(13)10-22/h3,6,9,14,16-17,25H,4-5,7-8,10-11,22H2,1-2H3,(H,23,26)