5-(3-hydroxyphenyl)-6-(2-piperidin-1-ylpropyl)-1,2,3,4-tetrahydroazepin-7-one

Systemtic Name: 5-(3-hydroxyphenyl)-6-(2-piperidin-1-ylpropyl)-1,2,3,4-tetrahydroazepin-7-one Openeye Name: 5-(3-hydroxyphenyl)-6-[2-(1-piperidyl)propyl]-1,2,3,4-tetrahydroazepin-7-one CAS Name: 5-(3-hydroxyphenyl)-6-[2-(1-piperidinyl)propyl]-1,2,3,4-tetrahydroazepin-7-one IUPAC Name: 5-(3-hydroxyphenyl)-6-(2-piperidin-1-ylpropyl)-1,2,3,4-tetrahydroazepin-7-one Traditional Name: 5-(3-hydroxyphenyl)-6-(2-piperidinopropyl)-1,2,3,4-tetrahydroazepin-7-one Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(CCCNC1=O)C2=CC(=CC=C2)O)N3CCCCC3

Isomeric SMILES

CC(CC1=C(CCCNC1=O)C2=CC(=CC=C2)O)N3CCCCC3

InChI

InChI=1S/C20H28N2O2/c1-15(22-11-3-2-4-12-22)13-19-18(9-6-10-21-20(19)24)16-7-5-8-17(23)14-16/h5,7-8,14-15,23H,2-4,6,9-13H2,1H3,(H,21,24)