5-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-3-phenyl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-3-phenyl-4,5-dihydro-1,2-oxazole Openeye Name: 5-[4-[4-(o-tolyl)piperazin-1-yl]butyl]-3-phenyl-4,5-dihydroisoxazole CAS Name: 5-[4-[4-(2-methylphenyl)-1-piperazinyl]butyl]-3-phenyl-4,5-dihydroisoxazole IUPAC Name: 5-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-3-phenyl-4,5-dihydro-1,2-oxazole Traditional Name: 5-[4-[4-(o-tolyl)piperazino]butyl]-3-phenyl-2-isoxazoline Formula: C24H31N3O MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCCC3CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCCC3CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C24H31N3O/c1-20-9-5-6-13-24(20)27-17-15-26(16-18-27)14-8-7-12-22-19-23(25-28-22)21-10-3-2-4-11-21/h2-6,9-11,13,22H,7-8,12,14-19H2,1H3