oxan-4-yl-[7-[(4-phenylpiperazin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone

Systemtic Name: oxan-4-yl-[7-[(4-phenylpiperazin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Openeye Name: [7-[(4-phenylpiperazin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-tetrahydropyran-4-yl-methanone CAS Name: 4-oxanyl-[7-[(4-phenyl-1-piperazinyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone IUPAC Name: oxan-4-yl-[7-[(4-phenylpiperazin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Traditional Name: [7-[(4-phenylpiperazino)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-tetrahydropyran-4-yl-methanone Formula: C26H33N3O3 MolecularWeight: 435.55852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1COCCC1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H33N3O3/c30-26(22-8-15-31-16-9-22)29-14-17-32-25-7-6-21(18-23(25)20-29)19-27-10-12-28(13-11-27)24-4-2-1-3-5-24/h1-7,18,22H,8-17,19-20H2