2-[4-(oxiran-2-ylmethoxy)phenyl]-8-(4-phenylpiperazin-1-yl)octanamide

Systemtic Name: 2-[4-(oxiran-2-ylmethoxy)phenyl]-8-(4-phenylpiperazin-1-yl)octanamide Openeye Name: 2-[4-(oxiran-2-ylmethoxy)phenyl]-8-(4-phenylpiperazin-1-yl)octanamide CAS Name: 2-[4-(2-oxiranylmethoxy)phenyl]-8-(4-phenyl-1-piperazinyl)octanamide IUPAC Name: 2-[4-(oxiran-2-ylmethoxy)phenyl]-8-(4-phenylpiperazin-1-yl)octanamide Traditional Name: 2-(4-glycidoxyphenyl)-8-(4-phenylpiperazino)caprylamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCCC(C2=CC=C(C=C2)OCC3CO3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCCCCC(C2=CC=C(C=C2)OCC3CO3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C27H37N3O3/c28-27(31)26(22-11-13-24(14-12-22)32-20-25-21-33-25)10-6-1-2-7-15-29-16-18-30(19-17-29)23-8-4-3-5-9-23/h3-5,8-9,11-14,25-26H,1-2,6-7,10,15-21H2,(H2,28,31)