5-[2-oxidanyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propoxy]chromen-2-one hydrochloride

Systemtic Name: 5-[2-oxidanyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propoxy]chromen-2-one hydrochloride Openeye Name: 5-[2-hydroxy-3-(tetralin-2-ylamino)propoxy]chromen-2-one hydrochloride CAS Name: 5-[2-hydroxy-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propoxy]-1-benzopyran-2-one hydrochloride IUPAC Name: 5-[2-hydroxy-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propoxy]chromen-2-one hydrochloride Traditional Name: 5-[2-hydroxy-3-(tetralin-2-ylamino)propoxy]coumarin hydrochloride Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2CC1NCC(COC3=CC=CC4=C3C=CC(=O)O4)O.Cl

Isomeric SMILES

C1CC2=CC=CC=C2CC1NCC(COC3=CC=CC4=C3C=CC(=O)O4)O.Cl

InChI

InChI=1S/C22H23NO4.ClH/c24-18(13-23-17-9-8-15-4-1-2-5-16(15)12-17)14-26-20-6-3-7-21-19(20)10-11-22(25)27-21;/h1-7,10-11,17-18,23-24H,8-9,12-14H2;1H