3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-yl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]cyclohexyl]propanoic acid

Systemtic Name: 3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-yl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]cyclohexyl]propanoic acid Openeye Name: 3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-yl)-2,5-dioxo-imidazolidin-1-yl]cyclohexyl]propanoic acid CAS Name: 3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-yl)-2,5-dioxo-1-imidazolidinyl]cyclohexyl]propanoic acid IUPAC Name: 3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-yl)-2,5-dioxoimidazolidin-1-yl]cyclohexyl]propanoic acid Traditional Name: 3-[4-[3-(7-ethyl-5,6,8,9-tetrahydropyrazin[2,3-d]azepin-3-yl)-2,5-diketo-imidazolidin-1-yl]cyclohexyl]propionic acid Formula: C22H31N5O4 MolecularWeight: 429.51264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=NC=C(N=C2CC1)N3CC(=O)N(C3=O)C4CCC(CC4)CCC(=O)O

Isomeric SMILES

CCN1CCC2=NC=C(N=C2CC1)N3CC(=O)N(C3=O)C4CCC(CC4)CCC(=O)O

InChI

InChI=1S/C22H31N5O4/c1-2-25-11-9-17-18(10-12-25)24-19(13-23-17)26-14-20(28)27(22(26)31)16-6-3-15(4-7-16)5-8-21(29)30/h13,15-16H,2-12,14H2,1H3,(H,29,30)