(5R)-5-(3-chlorophenyl)-5-ethyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione

Systemtic Name: (5R)-5-(3-chlorophenyl)-5-ethyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Openeye Name: (5R)-5-(3-chlorophenyl)-5-ethyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione CAS Name: (5R)-5-(3-chlorophenyl)-5-ethyl-3-[[4-(4-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]imidazolidine-2,4-dione IUPAC Name: (5R)-5-(3-chlorophenyl)-5-ethyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Traditional Name: (5R)-5-(3-chlorophenyl)-5-ethyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]hydantoin Formula: C21H26ClN5O2+2 MolecularWeight: 415.91644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H24ClN5O2/c1-2-21(16-4-3-5-17(22)14-16)19(28)27(20(29)24-21)15-25-10-12-26(13-11-25)18-6-8-23-9-7-18/h3-9,14H,2,10-13,15H2,1H3,(H,24,29)/p+2/t21-/m1/s1