3-(3-bromanyl-2H-pyridin-3-yl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one

Systemtic Name: 3-(3-bromanyl-2H-pyridin-3-yl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Openeye Name: 3-(3-bromo-2H-pyridin-3-yl)-7-hydroxy-4-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]chromen-2-one CAS Name: 3-(3-bromo-2H-pyridin-3-yl)-7-hydroxy-4-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(3-bromo-2H-pyridin-3-yl)-7-hydroxy-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Traditional Name: 3-(3-bromo-2H-pyridin-3-yl)-7-hydroxy-4-[4-(2-piperidinoethoxy)benzyl]coumarin Formula: C28H29BrN2O4 MolecularWeight: 537.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)CC3=C(C(=O)OC4=C3C=CC(=C4)O)C5(CN=CC=C5)Br

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)CC3=C(C(=O)OC4=C3C=CC(=C4)O)C5(CN=CC=C5)Br

InChI

InChI=1S/C28H29BrN2O4/c29-28(11-4-12-30-19-28)26-24(23-10-7-21(32)18-25(23)35-27(26)33)17-20-5-8-22(9-6-20)34-16-15-31-13-2-1-3-14-31/h4-12,18,32H,1-3,13-17,19H2