1-ethanoyl-5-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]pyrrolidin-2-one hydrate hydrochloride

Systemtic Name: 1-ethanoyl-5-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]pyrrolidin-2-one hydrate hydrochloride Openeye Name: 1-acetyl-5-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]pyrrolidin-2-one hydrate hydrochloride CAS Name: 1-acetyl-5-[4-[3-(4-phenyl-1-piperazinyl)propyl]phenyl]-2-pyrrolidinone hydrate hydrochloride IUPAC Name: 1-acetyl-5-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]pyrrolidin-2-one hydrate hydrochloride Traditional Name: 1-acetyl-5-[4-[3-(4-phenylpiperazino)propyl]phenyl]-2-pyrrolidone hydrate hydrochloride Formula: C25H34ClN3O3 MolecularWeight: 460.00876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CCC1=O)C2=CC=C(C=C2)CCCN3CCN(CC3)C4=CC=CC=C4.O.Cl

Isomeric SMILES

CC(=O)N1C(CCC1=O)C2=CC=C(C=C2)CCCN3CCN(CC3)C4=CC=CC=C4.O.Cl

InChI

InChI=1S/C25H31N3O2.ClH.H2O/c1-20(29)28-24(13-14-25(28)30)22-11-9-21(10-12-22)6-5-15-26-16-18-27(19-17-26)23-7-3-2-4-8-23;;/h2-4,7-12,24H,5-6,13-19H2,1H3;1H;1H2