(4S,5S,7S)-5-azanyl-N-butyl-7-[(4-tert-butylphenyl)methyl]-2,8-dimethyl-4-oxidanyl-nonanamide

Systemtic Name: (4S,5S,7S)-5-azanyl-N-butyl-7-[(4-tert-butylphenyl)methyl]-2,8-dimethyl-4-oxidanyl-nonanamide Openeye Name: (4S,5S,7S)-5-amino-N-butyl-7-[(4-tert-butylphenyl)methyl]-4-hydroxy-2,8-dimethyl-nonanamide CAS Name: (4S,5S,7S)-5-amino-N-butyl-7-[(4-tert-butylphenyl)methyl]-4-hydroxy-2,8-dimethylnonanamide IUPAC Name: (4S,5S,7S)-5-amino-N-butyl-7-[(4-tert-butylphenyl)methyl]-4-hydroxy-2,8-dimethylnonanamide Traditional Name: (4S,5S,7S)-5-amino-N-butyl-7-(4-tert-butylbenzyl)-4-hydroxy-2,8-dimethyl-pelargonamide Formula: C26H46N2O2 MolecularWeight: 418.65564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(CC1=CC=C(C=C1)C(C)(C)C)C(C)C)N)O

Isomeric SMILES

CCCCNC(=O)C(C)C[C@@H]([C@H](C[C@H](CC1=CC=C(C=C1)C(C)(C)C)C(C)C)N)O

InChI

InChI=1S/C26H46N2O2/c1-8-9-14-28-25(30)19(4)15-24(29)23(27)17-21(18(2)3)16-20-10-12-22(13-11-20)26(5,6)7/h10-13,18-19,21,23-24,29H,8-9,14-17,27H2,1-7H3,(H,28,30)/t19?,21-,23-,24-/m0/s1