2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(4-quinazolin-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(4-quinazolin-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(4-quinazolin-4-ylpiperazin-1-yl)ethanone CAS Name: 2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[4-(4-quinazolinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(4-quinazolin-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(4-quinazolin-4-ylpiperazino)ethanone Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=CC=CC=C32)C(=O)CN4CC(OC5=CC=CC=C5C4)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=CC=CC=C32)C(=O)CN4CC(OC5=CC=CC=C5C4)C6=CC=CC=C6

InChI

InChI=1S/C29H29N5O2/c35-28(33-14-16-34(17-15-33)29-24-11-5-6-12-25(24)30-21-31-29)20-32-18-23-10-4-7-13-26(23)36-27(19-32)22-8-2-1-3-9-22/h1-13,21,27H,14-20H2