5-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]butyl]-3-(3-nitrophenyl)-1,2-oxazole

Systemtic Name: 5-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]butyl]-3-(3-nitrophenyl)-1,2-oxazole Openeye Name: 5-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]butyl]-3-(3-nitrophenyl)isoxazole CAS Name: 5-[4-[4-(2-ethoxyphenyl)-1-piperazinyl]butyl]-3-(3-nitrophenyl)isoxazole IUPAC Name: 5-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]butyl]-3-(3-nitrophenyl)-1,2-oxazole Traditional Name: 3-(3-nitrophenyl)-5-[4-(4-o-phenetylpiperazino)butyl]isoxazole Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CCCCC3=CC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CCCCC3=CC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c1-2-32-25-12-4-3-11-24(25)28-16-14-27(15-17-28)13-6-5-10-22-19-23(26-33-22)20-8-7-9-21(18-20)29(30)31/h3-4,7-9,11-12,18-19H,2,5-6,10,13-17H2,1H3