1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-yl-piperidin-4-ol

Systemtic Name: 1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-yl-piperidin-4-ol Openeye Name: 1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridyl)piperidin-4-ol CAS Name: 1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridinyl)-4-piperidinol IUPAC Name: 1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-ylpiperidin-4-ol Traditional Name: 1-[[4-[(2S)-2-methylbutyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridyl)piperidin-4-ol Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)(C4=CN=CC=C4)O

Isomeric SMILES

CC[C@H](C)CN1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)(C4=CN=CC=C4)O

InChI

InChI=1S/C25H35N3O2/c1-3-20(2)17-28-13-14-30-24-7-6-21(15-22(24)19-28)18-27-11-8-25(29,9-12-27)23-5-4-10-26-16-23/h4-7,10,15-16,20,29H,3,8-9,11-14,17-19H2,1-2H3/t20-/m0/s1