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

Systemtic Name: 3-(2-chlorophenyl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Openeye Name: 3-(2-chlorophenyl)-7-hydroxy-4-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]chromen-2-one CAS Name: 3-(2-chlorophenyl)-7-hydroxy-4-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-(2-chlorophenyl)-7-hydroxy-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Traditional Name: 3-(2-chlorophenyl)-7-hydroxy-4-[4-(2-piperidinoethoxy)benzyl]coumarin Formula: C29H28ClNO4 MolecularWeight: 489.98992

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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=CC=C5Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)CC3=C(C(=O)OC4=C3C=CC(=C4)O)C5=CC=CC=C5Cl

InChI

InChI=1S/C29H28ClNO4/c30-26-7-3-2-6-24(26)28-25(23-13-10-21(32)19-27(23)35-29(28)33)18-20-8-11-22(12-9-20)34-17-16-31-14-4-1-5-15-31/h2-3,6-13,19,32H,1,4-5,14-18H2