7-(4-piperidin-1-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid

Systemtic Name: 7-(4-piperidin-1-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid Openeye Name: 7-[4-(1-piperidyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxylic acid CAS Name: 7-[4-(1-piperidinyl)phenyl]-2,3-dihydro-1-benzoxepin-4-carboxylic acid IUPAC Name: 7-(4-piperidin-1-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid Traditional Name: 7-(4-piperidinophenyl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C3=CC4=C(C=C3)OCCC(=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C3=CC4=C(C=C3)OCCC(=C4)C(=O)O

InChI

InChI=1S/C22H23NO3/c24-22(25)18-10-13-26-21-9-6-17(14-19(21)15-18)16-4-7-20(8-5-16)23-11-2-1-3-12-23/h4-9,14-15H,1-3,10-13H2,(H,24,25)