3,5-dimethyl-4-[4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde

Systemtic Name: 3,5-dimethyl-4-[4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde Openeye Name: 4-[4-[(1R)-1-(4-isopropylphenyl)ethyl]piperazin-4-ium-1-yl]-3,5-dimethyl-benzaldehyde CAS Name: 3,5-dimethyl-4-[4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]-1-piperazin-4-iumyl]benzaldehyde IUPAC Name: 3,5-dimethyl-4-[4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde Traditional Name: 3,5-dimethyl-4-[4-[(1R)-1-p-cumenylethyl]piperazin-4-ium-1-yl]benzaldehyde Formula: C24H33N2O+ MolecularWeight: 365.53162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N2CC[NH+](CC2)C(C)C3=CC=C(C=C3)C(C)C)C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1N2CC[NH+](CC2)[C@H](C)C3=CC=C(C=C3)C(C)C)C)C=O

InChI

InChI=1S/C24H32N2O/c1-17(2)22-6-8-23(9-7-22)20(5)25-10-12-26(13-11-25)24-18(3)14-21(16-27)15-19(24)4/h6-9,14-17,20H,10-13H2,1-5H3/p+1/t20-/m1/s1