[5-[(3,4-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [5-[(3,4-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [5-[(3,4-dimethylphenoxy)methyl]isoxazol-3-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [5-[(3,4-dimethylphenoxy)methyl]-3-isoxazolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [5-[(3,4-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [5-[(3,4-dimethylphenoxy)methyl]isoxazol-3-yl]-(4-phenylpiperazino)methanone Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC(=NO2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC(=NO2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H25N3O3/c1-17-8-9-20(14-18(17)2)28-16-21-15-22(24-29-21)23(27)26-12-10-25(11-13-26)19-6-4-3-5-7-19/h3-9,14-15H,10-13,16H2,1-2H3