4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)piperidin-1-yl]ethyl]phenol

Systemtic Name: 4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)piperidin-1-yl]ethyl]phenol Openeye Name: 4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)-1-piperidyl]ethyl]phenol CAS Name: 4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)-1-piperidinyl]ethyl]phenol IUPAC Name: 4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)piperidin-1-yl]ethyl]phenol Traditional Name: 4-[2-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzoxazepin-6-yl)piperidino]ethyl]phenol Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2C3=CC=CN3CC4=CC=CC=C4O2)CCC5=CC=C(C=C5)O

Isomeric SMILES

C1CN(CCC1C2C3=CC=CN3CC4=CC=CC=C4O2)CCC5=CC=C(C=C5)O

InChI

InChI=1S/C25H28N2O2/c28-22-9-7-19(8-10-22)11-15-26-16-12-20(13-17-26)25-23-5-3-14-27(23)18-21-4-1-2-6-24(21)29-25/h1-10,14,20,25,28H,11-13,15-18H2