5,5-bis(phenylmethyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazolidine-2,4-dione

Systemtic Name: 5,5-bis(phenylmethyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazolidine-2,4-dione Openeye Name: 5,5-dibenzyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazolidine-2,4-dione CAS Name: 5,5-bis(phenylmethyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazolidine-2,4-dione IUPAC Name: 5,5-dibenzyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazolidine-2,4-dione Traditional Name: 5,5-dibenzyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)hydantoin Formula: C27H28N3O2+ MolecularWeight: 426.53012

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CN3C(=O)C(NC3=O)(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CN3C(=O)C(NC3=O)(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c31-25-27(17-21-9-3-1-4-10-21,18-22-11-5-2-6-12-22)28-26(32)30(25)20-29-16-15-23-13-7-8-14-24(23)19-29/h1-14H,15-20H2,(H,28,32)/p+1