(4R,5R)-8-chloranyl-5-phenyl-4-(piperidin-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride

Systemtic Name: (4R,5R)-8-chloranyl-5-phenyl-4-(piperidin-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride Openeye Name: (4R,5R)-8-chloro-5-phenyl-4-(1-piperidylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride CAS Name: (4R,5R)-8-chloro-5-phenyl-4-(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride IUPAC Name: (4R,5R)-8-chloro-5-phenyl-4-(piperidin-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride Traditional Name: (4R,5R)-8-chloro-5-phenyl-4-(piperidinomethyl)-3,4-dihydro-2H-1-benzoxepin-5-ol hydrochloride Formula: C22H27Cl2NO2 MolecularWeight: 408.36128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2CCOC3=C(C2(C4=CC=CC=C4)O)C=CC(=C3)Cl.Cl

Isomeric SMILES

C1CCN(CC1)C[C@H]2CCOC3=C([C@@]2(C4=CC=CC=C4)O)C=CC(=C3)Cl.Cl

InChI

InChI=1S/C22H26ClNO2.ClH/c23-19-9-10-20-21(15-19)26-14-11-18(16-24-12-5-2-6-13-24)22(20,25)17-7-3-1-4-8-17;/h1,3-4,7-10,15,18,25H,2,5-6,11-14,16H2;1H/t18-,22+;/m1./s1