N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]heptanamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]heptanamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]heptanamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]heptanamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]heptanamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]enanthamide Formula: C25H32ClN3O2 MolecularWeight: 441.99348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32ClN3O2/c1-3-4-5-6-11-24(30)27-20-12-13-23(22(26)18-20)28-14-16-29(17-15-28)25(31)21-10-8-7-9-19(21)2/h7-10,12-13,18H,3-6,11,14-17H2,1-2H3,(H,27,30)