6-ethyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-ethyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-ethyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethyl-4-[[4-(2,3,4-trimethoxybenzyl)piperazino]methyl]coumarin Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C26H32N2O5/c1-5-18-6-8-22-21(14-18)20(15-24(29)33-22)17-28-12-10-27(11-13-28)16-19-7-9-23(30-2)26(32-4)25(19)31-3/h6-9,14-15H,5,10-13,16-17H2,1-4H3