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

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(2-ethoxypyridin-3-yl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-ethoxy-3-pyridyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(2-ethoxy-3-pyridinyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-ethoxypyridin-3-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-ethoxy-3-pyridyl)methanone Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-2-30-24-22(14-9-15-26-24)25(29)28-18-16-27(17-19-28)23(20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-15,23H,2,16-19H2,1H3/p+1