ethyl 5-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4,5-dihydro-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[4-(4-benzylpiperazin-1-yl)phenyl]-4,5-dihydroisoxazole-3-carboxylate CAS Name: 5-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4,5-dihydroisoxazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(4-benzylpiperazin-1-yl)phenyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Traditional Name: 5-[4-(4-benzylpiperazino)phenyl]-2-isoxazoline-3-carboxylic acid ethyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(C1)C2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NOC(C1)C2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3/c1-2-28-23(27)21-16-22(29-24-21)19-8-10-20(11-9-19)26-14-12-25(13-15-26)17-18-6-4-3-5-7-18/h3-11,22H,2,12-17H2,1H3