4-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde

Systemtic Name: 4-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Openeye Name: 4-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde CAS Name: 4-[4-[(1S)-1-phenylethyl]-1-piperazin-4-iumyl]benzaldehyde IUPAC Name: 4-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Traditional Name: 4-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Formula: C19H23N2O+ MolecularWeight: 295.39872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=C(C=C3)C=O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+]2CCN(CC2)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C19H22N2O/c1-16(18-5-3-2-4-6-18)20-11-13-21(14-12-20)19-9-7-17(15-22)8-10-19/h2-10,15-16H,11-14H2,1H3/p+1/t16-/m0/s1