4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3,5-dimethyl-benzaldehyde

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3,5-dimethyl-benzaldehyde Openeye Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3,5-dimethyl-benzaldehyde CAS Name: 4-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3,5-dimethylbenzaldehyde IUPAC Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3,5-dimethylbenzaldehyde Traditional Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3,5-dimethyl-benzaldehyde Formula: C26H29N2O+ MolecularWeight: 385.52126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C)C=O

InChI

InChI=1S/C26H28N2O/c1-20-17-22(19-29)18-21(2)25(20)27-13-15-28(16-14-27)26(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-12,17-19,26H,13-16H2,1-2H3/p+1