(5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(piperidin-1-ium-1-ylmethyl)imidazolidine-2,4-dione

Systemtic Name: (5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(piperidin-1-ium-1-ylmethyl)imidazolidine-2,4-dione Openeye Name: (5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(piperidin-1-ium-1-ylmethyl)imidazolidine-2,4-dione CAS Name: (5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(1-piperidin-1-iumylmethyl)imidazolidine-2,4-dione IUPAC Name: (5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(piperidin-1-ium-1-ylmethyl)imidazolidine-2,4-dione Traditional Name: (5S)-5-(3,4-dimethylphenyl)-5-phenyl-3-(piperidin-1-ium-1-ylmethyl)hydantoin Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2(C(=O)N(C(=O)N2)C[NH+]3CCCCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@]2(C(=O)N(C(=O)N2)C[NH+]3CCCCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O2/c1-17-11-12-20(15-18(17)2)23(19-9-5-3-6-10-19)21(27)26(22(28)24-23)16-25-13-7-4-8-14-25/h3,5-6,9-12,15H,4,7-8,13-14,16H2,1-2H3,(H,24,28)/p+1/t23-/m0/s1