7-chloranyl-2-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride

Systemtic Name: 7-chloranyl-2-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Openeye Name: 7-chloro-3-[(isopropylamino)methyl]-2-methyl-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride CAS Name: 7-chloro-2-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride IUPAC Name: 7-chloro-2-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Traditional Name: 7-chloro-3-[(isopropylamino)methyl]-2-methyl-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Formula: C14H21Cl2NO3 MolecularWeight: 322.22744

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(COC2=C(O1)C=CC(=C2)Cl)(CNC(C)C)O.Cl

Isomeric SMILES

CC1C(COC2=C(O1)C=CC(=C2)Cl)(CNC(C)C)O.Cl

InChI

InChI=1S/C14H20ClNO3.ClH/c1-9(2)16-7-14(17)8-18-13-6-11(15)4-5-12(13)19-10(14)3;/h4-6,9-10,16-17H,7-8H2,1-3H3;1H