3-(methoxymethyl)-4-[4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one

Systemtic Name: 3-(methoxymethyl)-4-[4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one Openeye Name: 3-(methoxymethyl)-4-[4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one CAS Name: 3-(methoxymethyl)-4-[4-[4-(6-methoxy-2-pyrazinyl)-1-piperazinyl]butyl]-8-methyl-1,4-benzoxazepin-5-one IUPAC Name: 3-(methoxymethyl)-4-[4-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]butyl]-8-methyl-1,4-benzoxazepin-5-one Traditional Name: 3-(methoxymethyl)-4-[4-[4-(6-methoxypyrazin-2-yl)piperazino]butyl]-8-methyl-1,4-benzoxazepin-5-one Formula: C25H33N5O4 MolecularWeight: 467.56062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C(=CO2)COC)CCCCN3CCN(CC3)C4=CN=CC(=N4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C(=CO2)COC)CCCCN3CCN(CC3)C4=CN=CC(=N4)OC

InChI

InChI=1S/C25H33N5O4/c1-19-6-7-21-22(14-19)34-18-20(17-32-2)30(25(21)31)9-5-4-8-28-10-12-29(13-11-28)23-15-26-16-24(27-23)33-3/h6-7,14-16,18H,4-5,8-13,17H2,1-3H3