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

Systemtic Name: 1-hexyl-2-methyl-5-oxidanyl-N-phenyl-4-(piperidin-1-ylmethyl)indole-3-carboxamide Openeye Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(1-piperidylmethyl)indole-3-carboxamide CAS Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(1-piperidinylmethyl)-3-indolecarboxamide IUPAC Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(piperidin-1-ylmethyl)indole-3-carboxamide Traditional Name: 1-hexyl-5-hydroxy-2-methyl-N-phenyl-4-(piperidinomethyl)indole-3-carboxamide Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O2/c1-3-4-5-12-19-31-21(2)26(28(33)29-22-13-8-6-9-14-22)27-23(25(32)16-15-24(27)31)20-30-17-10-7-11-18-30/h6,8-9,13-16,32H,3-5,7,10-12,17-20H2,1-2H3,(H,29,33)