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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OCCC5CCCCN5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OCCC5CCCCN5

InChI

InChI=1S/C29H28ClNO4/c1-33-24-13-14-25-26(18-24)35-29(32)28(20-5-9-21(30)10-6-20)27(25)19-7-11-23(12-8-19)34-17-15-22-4-2-3-16-31-22/h5-14,18,22,31H,2-4,15-17H2,1H3