4-(5-methoxy-2-oxidanyl-phenyl)-1-(4-phenylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(5-methoxy-2-oxidanyl-phenyl)-1-(4-phenylpiperazin-1-yl)butan-1-one Openeye Name: 4-(2-hydroxy-5-methoxy-phenyl)-1-(4-phenylpiperazin-1-yl)butan-1-one CAS Name: 4-(2-hydroxy-5-methoxyphenyl)-1-(4-phenyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(2-hydroxy-5-methoxyphenyl)-1-(4-phenylpiperazin-1-yl)butan-1-one Traditional Name: 4-(2-hydroxy-5-methoxy-phenyl)-1-(4-phenylpiperazino)butan-1-one Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CCCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)O)CCCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3/c1-26-19-10-11-20(24)17(16-19)6-5-9-21(25)23-14-12-22(13-15-23)18-7-3-2-4-8-18/h2-4,7-8,10-11,16,24H,5-6,9,12-15H2,1H3