1-[2-[1-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]quinazoline-2,4-dione

Systemtic Name: 1-[2-[1-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]quinazoline-2,4-dione Openeye Name: 1-[2-(1-benzylpiperidin-1-ium-1-yl)ethyl]quinazoline-2,4-dione CAS Name: 1-[2-[1-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]quinazoline-2,4-dione IUPAC Name: 1-[2-(1-benzylpiperidin-1-ium-1-yl)ethyl]quinazoline-2,4-dione Traditional Name: 1-[2-(1-benzylpiperidin-1-ium-1-yl)ethyl]quinazoline-2,4-quinone Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CCN2C3=CC=CC=C3C(=O)NC2=O)CC4=CC=CC=C4

Isomeric SMILES

C1CC[N+](CC1)(CCN2C3=CC=CC=C3C(=O)NC2=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2/c26-21-19-11-5-6-12-20(19)24(22(27)23-21)13-16-25(14-7-2-8-15-25)17-18-9-3-1-4-10-18/h1,3-6,9-12H,2,7-8,13-17H2/p+1