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

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-methyl-benzaldehyde Openeye Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3-methyl-benzaldehyde CAS Name: 4-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-methylbenzaldehyde IUPAC Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3-methylbenzaldehyde Traditional Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-3-methyl-benzaldehyde Formula: C25H27N2O+ MolecularWeight: 371.49468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)C=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O/c1-20-18-21(19-28)12-13-24(20)26-14-16-27(17-15-26)25(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,18-19,25H,14-17H2,1H3/p+1