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

Systemtic Name: 7-methyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-methyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-methyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-methyl-4-[[4-(2,3,4-trimethoxybenzyl)piperazino]methyl]coumarin Formula: C25H30N2O5 MolecularWeight: 438.5161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C25H30N2O5/c1-17-5-7-20-19(14-23(28)32-22(20)13-17)16-27-11-9-26(10-12-27)15-18-6-8-21(29-2)25(31-4)24(18)30-3/h5-8,13-14H,9-12,15-16H2,1-4H3