1-[(2R)-1-oxidanyl-4-[6-(4-phenylbutoxy)indol-1-yl]butan-2-yl]imidazole-4-carboxamide

Systemtic Name: 1-[(2R)-1-oxidanyl-4-[6-(4-phenylbutoxy)indol-1-yl]butan-2-yl]imidazole-4-carboxamide Openeye Name: 1-[(1R)-1-(hydroxymethyl)-3-[6-(4-phenylbutoxy)indol-1-yl]propyl]imidazole-4-carboxamide CAS Name: 1-[(2R)-1-hydroxy-4-[6-(4-phenylbutoxy)-1-indolyl]butan-2-yl]-4-imidazolecarboxamide IUPAC Name: 1-[(2R)-1-hydroxy-4-[6-(4-phenylbutoxy)indol-1-yl]butan-2-yl]imidazole-4-carboxamide Traditional Name: 1-[(1R)-1-methylol-3-[6-(4-phenylbutoxy)indol-1-yl]propyl]imidazole-4-carboxamide Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C=CN3CCC(CO)N4C=C(N=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C=CN3CC[C@H](CO)N4C=C(N=C4)C(=O)N

InChI

InChI=1S/C26H30N4O3/c27-26(32)24-17-30(19-28-24)22(18-31)12-14-29-13-11-21-9-10-23(16-25(21)29)33-15-5-4-8-20-6-2-1-3-7-20/h1-3,6-7,9-11,13,16-17,19,22,31H,4-5,8,12,14-15,18H2,(H2,27,32)/t22-/m1/s1