3-[4-[2-oxidanylidene-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)imidazolidin-1-yl]cyclohexyl]propanoic acid hydrochloride

Systemtic Name: 3-[4-[2-oxidanylidene-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)imidazolidin-1-yl]cyclohexyl]propanoic acid hydrochloride Openeye Name: 3-[4-[2-oxo-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)imidazolidin-1-yl]cyclohexyl]propanoic acid hydrochloride CAS Name: 3-[4-[2-oxo-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)-1-imidazolidinyl]cyclohexyl]propanoic acid hydrochloride IUPAC Name: 3-[4-[2-oxo-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)imidazolidin-1-yl]cyclohexyl]propanoic acid hydrochloride Traditional Name: 3-[4-[2-keto-3-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)imidazolidin-1-yl]cyclohexyl]propionic acid hydrochloride Formula: C22H32ClN3O3 MolecularWeight: 421.96078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CNC1)C=CC(=C2)N3CCN(C3=O)C4CCC(CC4)CCC(=O)O.Cl

Isomeric SMILES

C1CC2=C(CNC1)C=CC(=C2)N3CCN(C3=O)C4CCC(CC4)CCC(=O)O.Cl

InChI

InChI=1S/C22H31N3O3.ClH/c26-21(27)10-5-16-3-7-19(8-4-16)24-12-13-25(22(24)28)20-9-6-18-15-23-11-1-2-17(18)14-20;/h6,9,14,16,19,23H,1-5,7-8,10-13,15H2,(H,26,27);1H