1-[4-(diphenylmethyl)piperazin-1-yl]-4-[5-(4-ethoxyphenyl)-1,2-oxazol-3-yl]butan-1-one

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-4-[5-(4-ethoxyphenyl)-1,2-oxazol-3-yl]butan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-4-[5-(4-ethoxyphenyl)isoxazol-3-yl]butan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-4-[5-(4-ethoxyphenyl)-3-isoxazolyl]-1-butanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-4-[5-(4-ethoxyphenyl)-1,2-oxazol-3-yl]butan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-4-(5-p-phenetylisoxazol-3-yl)butan-1-one Formula: C32H35N3O3 MolecularWeight: 509.6386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=NO2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=NO2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H35N3O3/c1-2-37-29-18-16-25(17-19-29)30-24-28(33-38-30)14-9-15-31(36)34-20-22-35(23-21-34)32(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,16-19,24,32H,2,9,14-15,20-23H2,1H3