tert-butyl N-[(2S,3S,5R)-6-methyl-3-oxidanyl-1-phenyl-5-(pyridin-3-ylmethylcarbamoyl)heptan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S,5R)-6-methyl-3-oxidanyl-1-phenyl-5-(pyridin-3-ylmethylcarbamoyl)heptan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-methyl-4-(3-pyridylmethylcarbamoyl)hexyl]carbamate CAS Name: N-[(2S,3S,5R)-3-hydroxy-6-methyl-5-[oxo-(3-pyridinylmethylamino)methyl]-1-phenylheptan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S,5R)-3-hydroxy-6-methyl-1-phenyl-5-(pyridin-3-ylmethylcarbamoyl)heptan-2-yl]carbamate Traditional Name: N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-methyl-4-(3-pyridylmethylcarbamoyl)hexyl]carbamic acid tert-butyl ester Formula: C26H37N3O4 MolecularWeight: 455.58968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)C(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC(C)[C@@H](C[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C26H37N3O4/c1-18(2)21(24(31)28-17-20-12-9-13-27-16-20)15-23(30)22(14-19-10-7-6-8-11-19)29-25(32)33-26(3,4)5/h6-13,16,18,21-23,30H,14-15,17H2,1-5H3,(H,28,31)(H,29,32)/t21-,22+,23+/m1/s1