6-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]-3H-1,3-benzoxazol-2-one hydrochloride

Systemtic Name: 6-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]-3H-1,3-benzoxazol-2-one hydrochloride Openeye Name: 6-[4-[4-(1-naphthyl)piperazin-1-yl]butyl]-3H-1,3-benzoxazol-2-one hydrochloride CAS Name: 6-[4-[4-(1-naphthalenyl)-1-piperazinyl]butyl]-3H-1,3-benzoxazol-2-one hydrochloride IUPAC Name: 6-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]-3H-1,3-benzoxazol-2-one hydrochloride Traditional Name: 6-[4-[4-(1-naphthyl)piperazino]butyl]-3H-1,3-benzoxazol-2-one hydrochloride Formula: C25H28ClN3O2 MolecularWeight: 437.96172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC3=C(C=C2)NC(=O)O3)C4=CC=CC5=CC=CC=C54.Cl

Isomeric SMILES

C1CN(CCN1CCCCC2=CC3=C(C=C2)NC(=O)O3)C4=CC=CC5=CC=CC=C54.Cl

InChI

InChI=1S/C25H27N3O2.ClH/c29-25-26-22-12-11-19(18-24(22)30-25)6-3-4-13-27-14-16-28(17-15-27)23-10-5-8-20-7-1-2-9-21(20)23;/h1-2,5,7-12,18H,3-4,6,13-17H2,(H,26,29);1H