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

Systemtic Name: 8-chloranyl-4-(piperidin-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one hydrochloride Openeye Name: 8-chloro-4-(1-piperidylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one hydrochloride CAS Name: 8-chloro-4-(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one hydrochloride IUPAC Name: 8-chloro-4-(piperidin-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one hydrochloride Traditional Name: 8-chloro-4-(piperidinomethyl)-3,4-dihydro-2H-1-benzoxepin-5-one hydrochloride Formula: C16H21Cl2NO2 MolecularWeight: 330.24944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClNO2.ClH/c17-13-4-5-14-15(10-13)20-9-6-12(16(14)19)11-18-7-2-1-3-8-18;/h4-5,10,12H,1-3,6-9,11H2;1H