3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 3-(methoxymethyl)-4-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1,4-benzoxazepin-5-one CAS Name: 3-(methoxymethyl)-4-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 3-(methoxymethyl)-4-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 3-(methoxymethyl)-4-[4-[4-(2-pyridyl)piperazino]butyl]-1,4-benzoxazepin-5-one Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=COC2=CC=CC=C2C(=O)N1CCCCN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COCC1=COC2=CC=CC=C2C(=O)N1CCCCN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H30N4O3/c1-30-18-20-19-31-22-9-3-2-8-21(22)24(29)28(20)13-7-6-12-26-14-16-27(17-15-26)23-10-4-5-11-25-23/h2-5,8-11,19H,6-7,12-18H2,1H3