1-[7-[[3-(methoxymethyl)piperidin-1-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-2-yl-propan-1-one

Systemtic Name: 1-[7-[[3-(methoxymethyl)piperidin-1-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-2-yl-propan-1-one Openeye Name: 1-[7-[[3-(methoxymethyl)-1-piperidyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-pyridyl)propan-1-one CAS Name: 1-[7-[[3-(methoxymethyl)-1-piperidinyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-pyridinyl)-1-propanone IUPAC Name: 1-[7-[[3-(methoxymethyl)piperidin-1-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-pyridin-2-ylpropan-1-one Traditional Name: 1-[7-[[3-(methoxymethyl)piperidino]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-3-(2-pyridyl)propan-1-one Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN(C1)CC2=CC3=C(C=C2)OCCN(C3)C(=O)CCC4=CC=CC=N4

Isomeric SMILES

COCC1CCCN(C1)CC2=CC3=C(C=C2)OCCN(C3)C(=O)CCC4=CC=CC=N4

InChI

InChI=1S/C25H33N3O3/c1-30-19-21-5-4-12-27(17-21)16-20-7-9-24-22(15-20)18-28(13-14-31-24)25(29)10-8-23-6-2-3-11-26-23/h2-3,6-7,9,11,15,21H,4-5,8,10,12-14,16-19H2,1H3