4-[2-[7-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol

Systemtic Name: 4-[2-[7-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol Openeye Name: 4-[2-[7-[[4-(3-pyridyloxy)-1-piperidyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol CAS Name: 4-[2-[7-[[4-(3-pyridinyloxy)-1-piperidinyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol IUPAC Name: 4-[2-[7-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol Traditional Name: 4-[2-[7-[[4-(3-pyridyloxy)piperidino]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propyl]phenol Formula: C29H35N3O3 MolecularWeight: 473.6065

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)O)N2CCOC3=C(C2)C=C(C=C3)CN4CCC(CC4)OC5=CN=CC=C5

Isomeric SMILES

CC(CC1=CC=C(C=C1)O)N2CCOC3=C(C2)C=C(C=C3)CN4CCC(CC4)OC5=CN=CC=C5

InChI

InChI=1S/C29H35N3O3/c1-22(17-23-4-7-26(33)8-5-23)32-15-16-34-29-9-6-24(18-25(29)21-32)20-31-13-10-27(11-14-31)35-28-3-2-12-30-19-28/h2-9,12,18-19,22,27,33H,10-11,13-17,20-21H2,1H3