N-(2-azanyl-3-methyl-butanoyl)-N-[(4-dimethylaminophenyl)methyl]-4-oxidanyl-6-phenyl-2-(phenylmethyl)hexanamide

Systemtic Name: N-(2-azanyl-3-methyl-butanoyl)-N-[(4-dimethylaminophenyl)methyl]-4-oxidanyl-6-phenyl-2-(phenylmethyl)hexanamide Openeye Name: N-(2-amino-3-methyl-butanoyl)-2-benzyl-N-[(4-dimethylaminophenyl)methyl]-4-hydroxy-6-phenyl-hexanamide CAS Name: N-(2-amino-3-methyl-1-oxobutyl)-N-[(4-dimethylaminophenyl)methyl]-4-hydroxy-6-phenyl-2-(phenylmethyl)hexanamide IUPAC Name: N-(2-amino-3-methylbutanoyl)-2-benzyl-N-[(4-dimethylaminophenyl)methyl]-4-hydroxy-6-phenylhexanamide Traditional Name: N-(2-amino-3-methyl-butanoyl)-2-benzyl-N-[4-(dimethylamino)benzyl]-4-hydroxy-6-phenyl-hexanamide Formula: C33H43N3O3 MolecularWeight: 529.71282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(CC1=CC=C(C=C1)N(C)C)C(=O)C(CC2=CC=CC=C2)CC(CCC3=CC=CC=C3)O)N

Isomeric SMILES

CC(C)C(C(=O)N(CC1=CC=C(C=C1)N(C)C)C(=O)C(CC2=CC=CC=C2)CC(CCC3=CC=CC=C3)O)N

InChI

InChI=1S/C33H43N3O3/c1-24(2)31(34)33(39)36(23-27-15-18-29(19-16-27)35(3)4)32(38)28(21-26-13-9-6-10-14-26)22-30(37)20-17-25-11-7-5-8-12-25/h5-16,18-19,24,28,30-31,37H,17,20-23,34H2,1-4H3