3,7-dimethyl-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3,7-dimethyl-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 3,7-dimethyl-4-[4-[4-(2-pyridyl)-1-piperidyl]butyl]-1,4-benzoxazepin-5-one CAS Name: 3,7-dimethyl-4-[4-[4-(2-pyridinyl)-1-piperidinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 3,7-dimethyl-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 3,7-dimethyl-4-[4-[4-(2-pyridyl)piperidino]butyl]-1,4-benzoxazepin-5-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(N(C2=O)CCCCN3CCC(CC3)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(N(C2=O)CCCCN3CCC(CC3)C4=CC=CC=N4)C

InChI

InChI=1S/C25H31N3O2/c1-19-8-9-24-22(17-19)25(29)28(20(2)18-30-24)14-6-5-13-27-15-10-21(11-16-27)23-7-3-4-12-26-23/h3-4,7-9,12,17-18,21H,5-6,10-11,13-16H2,1-2H3