N-[(2S,4S,5S)-4-azanyl-5-oxidanyl-6-piperidin-1-yl-2-propan-2-yl-hexyl]-2-(4-methoxybutoxy)benzamide

Systemtic Name: N-[(2S,4S,5S)-4-azanyl-5-oxidanyl-6-piperidin-1-yl-2-propan-2-yl-hexyl]-2-(4-methoxybutoxy)benzamide Openeye Name: N-[(2S,4S,5S)-4-amino-5-hydroxy-2-isopropyl-6-(1-piperidyl)hexyl]-2-(4-methoxybutoxy)benzamide CAS Name: N-[(2S,4S,5S)-4-amino-5-hydroxy-6-(1-piperidinyl)-2-propan-2-ylhexyl]-2-(4-methoxybutoxy)benzamide IUPAC Name: N-[(2S,4S,5S)-4-amino-5-hydroxy-6-piperidin-1-yl-2-propan-2-ylhexyl]-2-(4-methoxybutoxy)benzamide Traditional Name: N-[(2S,4S,5S)-4-amino-5-hydroxy-2-isopropyl-6-piperidino-hexyl]-2-(4-methoxybutoxy)benzamide Formula: C26H45N3O4 MolecularWeight: 463.6532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C(CN1CCCCC1)O)N)CNC(=O)C2=CC=CC=C2OCCCCOC

Isomeric SMILES

CC(C)[C@H](C[C@@H]([C@H](CN1CCCCC1)O)N)CNC(=O)C2=CC=CC=C2OCCCCOC

InChI

InChI=1S/C26H45N3O4/c1-20(2)21(17-23(27)24(30)19-29-13-7-4-8-14-29)18-28-26(31)22-11-5-6-12-25(22)33-16-10-9-15-32-3/h5-6,11-12,20-21,23-24,30H,4,7-10,13-19,27H2,1-3H3,(H,28,31)/t21-,23+,24+/m1/s1