3-methyl-4-[4-[(1R)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde

Systemtic Name: 3-methyl-4-[4-[(1R)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Openeye Name: 3-methyl-4-[4-[(1R)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde CAS Name: 3-methyl-4-[4-[(1R)-1-phenylethyl]-1-piperazin-4-iumyl]benzaldehyde IUPAC Name: 3-methyl-4-[4-[(1R)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Traditional Name: 3-methyl-4-[4-[(1R)-1-phenylethyl]piperazin-4-ium-1-yl]benzaldehyde Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)C(C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O/c1-16-14-18(15-23)8-9-20(16)22-12-10-21(11-13-22)17(2)19-6-4-3-5-7-19/h3-9,14-15,17H,10-13H2,1-2H3/p+1/t17-/m1/s1