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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C3=C(C(=O)OC4=C3C=CC(=C4)O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H28ClNO4/c30-22-9-5-21(6-10-22)28-27(25-14-11-23(32)19-26(25)35-29(28)33)20-7-12-24(13-8-20)34-18-4-17-31-15-2-1-3-16-31/h5-14,19,32H,1-4,15-18H2