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

Systemtic Name: 4-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Openeye Name: 3-[(isopropylamino)methyl]-4-methyl-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride CAS Name: 4-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride IUPAC Name: 4-methyl-3-[(propan-2-ylamino)methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Traditional Name: 3-[(isopropylamino)methyl]-4-methyl-2,4-dihydro-1,5-benzodioxepin-3-ol hydrochloride Formula: C14H22ClNO3 MolecularWeight: 287.78238

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(COC2=CC=CC=C2O1)(CNC(C)C)O.Cl

Isomeric SMILES

CC1C(COC2=CC=CC=C2O1)(CNC(C)C)O.Cl

InChI

InChI=1S/C14H21NO3.ClH/c1-10(2)15-8-14(16)9-17-12-6-4-5-7-13(12)18-11(14)3;/h4-7,10-11,15-16H,8-9H2,1-3H3;1H