3-(3,4-dimethoxyphenyl)-5-[4-(4-phenylpiperazin-1-yl)butyl]-1,2-oxazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-phenylpiperazin-1-yl)butyl]-1,2-oxazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-phenylpiperazin-1-yl)butyl]isoxazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-phenyl-1-piperazinyl)butyl]isoxazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-phenylpiperazin-1-yl)butyl]-1,2-oxazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-phenylpiperazino)butyl]isoxazole Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=C2)CCCCN3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=C2)CCCCN3CCN(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H31N3O3/c1-29-24-12-11-20(18-25(24)30-2)23-19-22(31-26-23)10-6-7-13-27-14-16-28(17-15-27)21-8-4-3-5-9-21/h3-5,8-9,11-12,18-19H,6-7,10,13-17H2,1-2H3