4-[5-[2-[(4-methylpiperazin-1-yl)methyl]-1-oxidanyl-butyl]-1,2-oxazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-[2-[(4-methylpiperazin-1-yl)methyl]-1-oxidanyl-butyl]-1,2-oxazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-[1-hydroxy-2-[(4-methylpiperazin-1-yl)methyl]butyl]isoxazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[1-hydroxy-2-[(4-methyl-1-piperazinyl)methyl]butyl]-3-isoxazolylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-[1-hydroxy-2-[(4-methylpiperazin-1-yl)methyl]butyl]-1,2-oxazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[1-hydroxy-2-[(4-methylpiperazino)methyl]butyl]-4-isoxazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CCN(CC1)C)C(C2=CC(=C3C=CC(=O)C=C3)NO2)O

Isomeric SMILES

CCC(CN1CCN(CC1)C)C(C2=CC(=C3C=CC(=O)C=C3)NO2)O

InChI

InChI=1S/C19H27N3O3/c1-3-14(13-22-10-8-21(2)9-11-22)19(24)18-12-17(20-25-18)15-4-6-16(23)7-5-15/h4-7,12,14,19-20,24H,3,8-11,13H2,1-2H3