6-ethyl-4-[[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[4-[2-(4-methoxyphenoxy)ethyl]piperazino]methyl]coumarin Formula: C25H30N2O5 MolecularWeight: 438.5161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CCOC4=CC=C(C=C4)OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CCOC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C25H30N2O5/c1-3-18-14-22-19(15-25(29)32-24(22)16-23(18)28)17-27-10-8-26(9-11-27)12-13-31-21-6-4-20(30-2)5-7-21/h4-7,14-16,28H,3,8-13,17H2,1-2H3