N-[(2R,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-propoxy-benzamide

Systemtic Name: N-[(2R,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-propoxy-benzamide Openeye Name: N-[(2R,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-propoxy-benzamide CAS Name: N-[(2R,4S,5S,7S)-4-amino-7-[butylamino(oxo)methyl]-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-propoxybenzamide IUPAC Name: N-[(2R,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-propoxybenzamide Traditional Name: N-[(2R,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-propoxy-benzamide Formula: C28H49N3O4 MolecularWeight: 491.70636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC(C(CC(CNC(=O)C1=CC=CC=C1OCCC)C(C)C)N)O)C(C)C

Isomeric SMILES

CCCCNC(=O)[C@@H](C[C@@H]([C@H](C[C@@H](CNC(=O)C1=CC=CC=C1OCCC)C(C)C)N)O)C(C)C

InChI

InChI=1S/C28H49N3O4/c1-7-9-14-30-28(34)23(20(5)6)17-25(32)24(29)16-21(19(3)4)18-31-27(33)22-12-10-11-13-26(22)35-15-8-2/h10-13,19-21,23-25,32H,7-9,14-18,29H2,1-6H3,(H,30,34)(H,31,33)/t21-,23-,24-,25-/m0/s1