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

Systemtic Name: N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]nonanamide Openeye Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]nonanamide CAS Name: N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]nonanamide IUPAC Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]nonanamide Traditional Name: N-[4-(4-o-toluoylpiperazino)phenyl]pelargonamide Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O2/c1-3-4-5-6-7-8-13-26(31)28-23-14-16-24(17-15-23)29-18-20-30(21-19-29)27(32)25-12-10-9-11-22(25)2/h9-12,14-17H,3-8,13,18-21H2,1-2H3,(H,28,31)