1-[(6-bromanyl-3,4-dihydro-2H-chromen-2-yl)methyl-(phenylmethyl)amino]-3-phenoxy-propan-2-ol hydrobromide

Systemtic Name: 1-[(6-bromanyl-3,4-dihydro-2H-chromen-2-yl)methyl-(phenylmethyl)amino]-3-phenoxy-propan-2-ol hydrobromide Openeye Name: 1-[benzyl-[(6-bromochroman-2-yl)methyl]amino]-3-phenoxy-propan-2-ol hydrobromide CAS Name: 1-[(6-bromo-3,4-dihydro-2H-1-benzopyran-2-yl)methyl-(phenylmethyl)amino]-3-phenoxy-2-propanol hydrobromide IUPAC Name: 1-[benzyl-[(6-bromo-3,4-dihydro-2H-chromen-2-yl)methyl]amino]-3-phenoxypropan-2-ol hydrobromide Traditional Name: 1-[benzyl-[(6-bromochroman-2-yl)methyl]amino]-3-phenoxy-propan-2-ol hydrobromide Formula: C26H29Br2NO3 MolecularWeight: 563.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)Br)OC1CN(CC3=CC=CC=C3)CC(COC4=CC=CC=C4)O.Br

Isomeric SMILES

C1CC2=C(C=CC(=C2)Br)OC1CN(CC3=CC=CC=C3)CC(COC4=CC=CC=C4)O.Br

InChI

InChI=1S/C26H28BrNO3.BrH/c27-22-12-14-26-21(15-22)11-13-25(31-26)18-28(16-20-7-3-1-4-8-20)17-23(29)19-30-24-9-5-2-6-10-24;/h1-10,12,14-15,23,25,29H,11,13,16-19H2;1H