6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanoyl]piperidin-4-yl]-2-methyl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanoyl]piperidin-4-yl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetyl]-4-piperidyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-oxoethyl]-4-piperidinyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetyl]piperidin-4-yl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 6-[1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetyl]-4-piperidyl]-2-methyl-1H-pyrimidin-4-one Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C=C(N1)C2CCN(CC2)C(=O)CN3CCOC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC(=O)C=C(N1)C2CCN(CC2)C(=O)CN3CCOC4=CC=CC=C4C3

InChI

InChI=1S/C21H26N4O3/c1-15-22-18(12-20(26)23-15)16-6-8-25(9-7-16)21(27)14-24-10-11-28-19-5-3-2-4-17(19)13-24/h2-5,12,16H,6-11,13-14H2,1H3,(H,22,23,26)