[4-(diphenylmethyl)piperazin-4-ium-1-yl]-[3-(2-phenoxyethoxy)phenyl]methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-[3-(2-phenoxyethoxy)phenyl]methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-[3-(2-phenoxyethoxy)phenyl]methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-[3-(2-phenoxyethoxy)phenyl]methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-[3-(2-phenoxyethoxy)phenyl]methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-[3-(2-phenoxyethoxy)phenyl]methanone Formula: C32H33N2O3+ MolecularWeight: 493.61602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)OCCOC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)OCCOC5=CC=CC=C5

InChI

InChI=1S/C32H32N2O3/c35-32(28-15-10-18-30(25-28)37-24-23-36-29-16-8-3-9-17-29)34-21-19-33(20-22-34)31(26-11-4-1-5-12-26)27-13-6-2-7-14-27/h1-18,25,31H,19-24H2/p+1