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

Systemtic Name: N-[[2-(aminomethyl)-5-chloranyl-phenyl]methyl]-1-(3-cyclopropyl-2-oxidanyl-butanoyl)azetidine-2-carboxamide Openeye Name: N-[[2-(aminomethyl)-5-chloro-phenyl]methyl]-1-(3-cyclopropyl-2-hydroxy-butanoyl)azetidine-2-carboxamide CAS Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(3-cyclopropyl-2-hydroxy-1-oxobutyl)-2-azetidinecarboxamide IUPAC Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-(3-cyclopropyl-2-hydroxybutanoyl)azetidine-2-carboxamide Traditional Name: N-[2-(aminomethyl)-5-chloro-benzyl]-1-(3-cyclopropyl-2-hydroxy-butanoyl)azetidine-2-carboxamide Formula: C19H26ClN3O3 MolecularWeight: 379.88104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26ClN3O3/c1-11(12-2-3-12)17(24)19(26)23-7-6-16(23)18(25)22-10-14-8-15(20)5-4-13(14)9-21/h4-5,8,11-12,16-17,24H,2-3,6-7,9-10,21H2,1H3,(H,22,25)