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

Systemtic Name: 3-(2-chlorophenyl)-7-oxidanyl-4-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-2-one Openeye Name: 3-(2-chlorophenyl)-7-hydroxy-4-[4-[2-(1-piperidyl)ethoxy]phenyl]chromen-2-one CAS Name: 3-(2-chlorophenyl)-7-hydroxy-4-[4-[2-(1-piperidinyl)ethoxy]phenyl]-1-benzopyran-2-one IUPAC Name: 3-(2-chlorophenyl)-7-hydroxy-4-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-2-one Traditional Name: 3-(2-chlorophenyl)-7-hydroxy-4-[4-(2-piperidinoethoxy)phenyl]coumarin Formula: C28H26ClNO4 MolecularWeight: 475.96334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)C5=CC=CC=C5Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)C5=CC=CC=C5Cl

InChI

InChI=1S/C28H26ClNO4/c29-24-7-3-2-6-22(24)27-26(23-13-10-20(31)18-25(23)34-28(27)32)19-8-11-21(12-9-19)33-17-16-30-14-4-1-5-15-30/h2-3,6-13,18,31H,1,4-5,14-17H2