4-[4-(4-phenylpiperazin-1-yl)but-1-ynyl]benzaldehyde

Systemtic Name: 4-[4-(4-phenylpiperazin-1-yl)but-1-ynyl]benzaldehyde Openeye Name: 4-[4-(4-phenylpiperazin-1-yl)but-1-ynyl]benzaldehyde CAS Name: 4-[4-(4-phenyl-1-piperazinyl)but-1-ynyl]benzaldehyde IUPAC Name: 4-[4-(4-phenylpiperazin-1-yl)but-1-ynyl]benzaldehyde Traditional Name: 4-[4-(4-phenylpiperazino)but-1-ynyl]benzaldehyde Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#CC2=CC=C(C=C2)C=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC#CC2=CC=C(C=C2)C=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O/c24-18-20-11-9-19(10-12-20)6-4-5-13-22-14-16-23(17-15-22)21-7-2-1-3-8-21/h1-3,7-12,18H,5,13-17H2