N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]octanamide

Systemtic Name: N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]octanamide Openeye Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]octanamide CAS Name: N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]octanamide IUPAC Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]octanamide Traditional Name: N-[4-(4-o-toluoylpiperazino)phenyl]caprylamide Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C

InChI

InChI=1S/C26H35N3O2/c1-3-4-5-6-7-12-25(30)27-22-13-15-23(16-14-22)28-17-19-29(20-18-28)26(31)24-11-9-8-10-21(24)2/h8-11,13-16H,3-7,12,17-20H2,1-2H3,(H,27,30)