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

Systemtic Name: 3-(4-chloranylphenoxy)-7-oxidanyl-4-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-2-one Openeye Name: 3-(4-chlorophenoxy)-7-hydroxy-4-[4-[2-(1-piperidyl)ethoxy]phenyl]chromen-2-one CAS Name: 3-(4-chlorophenoxy)-7-hydroxy-4-[4-[2-(1-piperidinyl)ethoxy]phenyl]-1-benzopyran-2-one IUPAC Name: 3-(4-chlorophenoxy)-7-hydroxy-4-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-2-one Traditional Name: 3-(4-chlorophenoxy)-7-hydroxy-4-[4-(2-piperidinoethoxy)phenyl]coumarin Formula: C28H26ClNO5 MolecularWeight: 491.96274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)OC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)OC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H26ClNO5/c29-20-6-11-23(12-7-20)34-27-26(24-13-8-21(31)18-25(24)35-28(27)32)19-4-9-22(10-5-19)33-17-16-30-14-2-1-3-15-30/h4-13,18,31H,1-3,14-17H2