[4-(4-methoxyphenyl)piperazin-1-yl]-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]methanone

Systemtic Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]methanone Openeye Name: [4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C23H26N2O3/c1-23(2,27)13-12-18-4-6-19(7-5-18)22(26)25-16-14-24(15-17-25)20-8-10-21(28-3)11-9-20/h4-11,27H,14-17H2,1-3H3