3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-1,3-benzoxazin-4-one hydrochloride

Systemtic Name: 3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-1,3-benzoxazin-4-one hydrochloride Openeye Name: 3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-1,3-benzoxazin-4-one hydrochloride CAS Name: 3-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-2H-1,3-benzoxazin-4-one hydrochloride IUPAC Name: 3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-1,3-benzoxazin-4-one hydrochloride Traditional Name: 3-[4-[4-(2-methoxyphenyl)piperazino]butyl]-2H-1,3-benzoxazin-4-one hydrochloride Formula: C23H30ClN3O3 MolecularWeight: 431.9556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCN3COC4=CC=CC=C4C3=O.Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCN3COC4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C23H29N3O3.ClH/c1-28-22-11-5-3-9-20(22)25-16-14-24(15-17-25)12-6-7-13-26-18-29-21-10-4-2-8-19(21)23(26)27;/h2-5,8-11H,6-7,12-18H2,1H3;1H