3-(chloromethyl)-6-[2-(4-pentylpiperazin-1-yl)phenyl]-1H-pyridin-2-one hydrochloride

Systemtic Name: 3-(chloromethyl)-6-[2-(4-pentylpiperazin-1-yl)phenyl]-1H-pyridin-2-one hydrochloride Openeye Name: 3-(chloromethyl)-6-[2-(4-pentylpiperazin-1-yl)phenyl]-1H-pyridin-2-one hydrochloride CAS Name: 3-(chloromethyl)-6-[2-(4-pentyl-1-piperazinyl)phenyl]-1H-pyridin-2-one hydrochloride IUPAC Name: 3-(chloromethyl)-6-[2-(4-pentylpiperazin-1-yl)phenyl]-1H-pyridin-2-one hydrochloride Traditional Name: 6-[2-(4-amylpiperazino)phenyl]-3-(chloromethyl)-2-pyridone hydrochloride Formula: C21H29Cl2N3O MolecularWeight: 410.38046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCN(CC1)C2=CC=CC=C2C3=CC=C(C(=O)N3)CCl.Cl

Isomeric SMILES

CCCCCN1CCN(CC1)C2=CC=CC=C2C3=CC=C(C(=O)N3)CCl.Cl

InChI

InChI=1S/C21H28ClN3O.ClH/c1-2-3-6-11-24-12-14-25(15-13-24)20-8-5-4-7-18(20)19-10-9-17(16-22)21(26)23-19;/h4-5,7-10H,2-3,6,11-16H2,1H3,(H,23,26);1H