(2S)-1-[(2R)-2-azanyl-4-methyl-pentanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2R)-2-azanyl-4-methyl-pentanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2R)-2-amino-4-methyl-pentanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2R)-2-amino-4-methyl-1-oxopentyl]-N-[(3-chlorophenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2R)-2-amino-4-methylpentanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2R)-2-amino-4-methyl-pentanoyl]-N-(3-chlorobenzyl)pyrrolidine-2-carboxamide Formula: C18H26ClN3O2 MolecularWeight: 351.87094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCC1C(=O)NCC2=CC(=CC=C2)Cl)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N1CCC[C@H]1C(=O)NCC2=CC(=CC=C2)Cl)N

InChI

InChI=1S/C18H26ClN3O2/c1-12(2)9-15(20)18(24)22-8-4-7-16(22)17(23)21-11-13-5-3-6-14(19)10-13/h3,5-6,10,12,15-16H,4,7-9,11,20H2,1-2H3,(H,21,23)/t15-,16+/m1/s1