1-hexyl-2-methyl-5-oxidanyl-N-phenyl-4-(piperidin-1-ylmethyl)-6-propanoyl-indole-3-carboxamide

Systemtic Name: 1-hexyl-2-methyl-5-oxidanyl-N-phenyl-4-(piperidin-1-ylmethyl)-6-propanoyl-indole-3-carboxamide Openeye Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(1-piperidylmethyl)-6-propanoyl-indole-3-carboxamide CAS Name: 1-hexyl-5-hydroxy-2-methyl-6-(1-oxopropyl)-N-phenyl-4-(1-piperidinylmethyl)-3-indolecarboxamide IUPAC Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(piperidin-1-ylmethyl)-6-propanoylindole-3-carboxamide Traditional Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(piperidinomethyl)-6-propionyl-indole-3-carboxamide Formula: C31H41N3O3 MolecularWeight: 503.67554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=C1C=C(C(=C2CN3CCCCC3)O)C(=O)CC)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CCCCCCN1C(=C(C2=C1C=C(C(=C2CN3CCCCC3)O)C(=O)CC)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C31H41N3O3/c1-4-6-7-14-19-34-22(3)28(31(37)32-23-15-10-8-11-16-23)29-25(21-33-17-12-9-13-18-33)30(36)24(20-26(29)34)27(35)5-2/h8,10-11,15-16,20,36H,4-7,9,12-14,17-19,21H2,1-3H3,(H,32,37)