3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propanoic acid

Systemtic Name: 3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propanoic acid Openeye Name: 3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propanoic acid CAS Name: 3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propanoic acid IUPAC Name: 3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propanoic acid Traditional Name: 3-[7-(3-cyclohexylpropoxy)-1,3,4,5-tetrahydro-2-benzazepin-2-yl]propionic acid Formula: C22H33NO3 MolecularWeight: 359.50232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCOC2=CC3=C(CN(CCC3)CCC(=O)O)C=C2

Isomeric SMILES

C1CCC(CC1)CCCOC2=CC3=C(CN(CCC3)CCC(=O)O)C=C2

InChI

InChI=1S/C22H33NO3/c24-22(25)12-14-23-13-4-9-19-16-21(11-10-20(19)17-23)26-15-5-8-18-6-2-1-3-7-18/h10-11,16,18H,1-9,12-15,17H2,(H,24,25)