5-[3-(4-methylpiperazin-1-yl)propyl]-3-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one dihydrochloride

Systemtic Name: 5-[3-(4-methylpiperazin-1-yl)propyl]-3-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one dihydrochloride Openeye Name: 5-[3-(4-methylpiperazin-1-yl)propyl]-3-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one dihydrochloride CAS Name: 5-[3-(4-methyl-1-piperazinyl)propyl]-3-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one dihydrochloride IUPAC Name: 5-[3-(4-methylpiperazin-1-yl)propyl]-3-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one dihydrochloride Traditional Name: 5-[3-(4-methylpiperazino)propyl]-3-phenyl-6,7-dihydro-5H-indoxazen-4-one dihydrochloride Formula: C21H29Cl2N3O2 MolecularWeight: 426.37986

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCC2CCC3=C(C2=O)C(=NO3)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CCCC2CCC3=C(C2=O)C(=NO3)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C21H27N3O2.2ClH/c1-23-12-14-24(15-13-23)11-5-8-17-9-10-18-19(21(17)25)20(22-26-18)16-6-3-2-4-7-16;;/h2-4,6-7,17H,5,8-15H2,1H3;2*1H