5-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylpyran-2-one

Systemtic Name: 5-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylpyran-2-one Openeye Name: 5-(4-benzhydrylpiperazin-4-ium-1-carbonyl)pyran-2-one CAS Name: 5-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-2-pyranone IUPAC Name: 5-(4-benzhydrylpiperazin-4-ium-1-carbonyl)pyran-2-one Traditional Name: 5-(4-benzhydrylpiperazin-4-ium-1-carbonyl)pyran-2-one Formula: C23H23N2O3+ MolecularWeight: 375.44032

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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=COC(=O)C=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O3/c26-21-12-11-20(17-28-21)23(27)25-15-13-24(14-16-25)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,22H,13-16H2/p+1