3-(4-bromophenyl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one

Systemtic Name: 3-(4-bromophenyl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Openeye Name: 3-(4-bromophenyl)-7-hydroxy-4-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]chromen-2-one CAS Name: 3-(4-bromophenyl)-7-hydroxy-4-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(4-bromophenyl)-7-hydroxy-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Traditional Name: 3-(4-bromophenyl)-7-hydroxy-4-[4-(2-piperidinoethoxy)benzyl]coumarin Formula: C29H28BrNO4 MolecularWeight: 534.44092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28BrNO4/c30-22-8-6-21(7-9-22)28-26(25-13-10-23(32)19-27(25)35-29(28)33)18-20-4-11-24(12-5-20)34-17-16-31-14-2-1-3-15-31/h4-13,19,32H,1-3,14-18H2