6-ethoxy-4-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-ethoxy-4-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-ethoxy-4-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethoxy-4-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethoxy-4-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethoxy-4-[[4-(3-methylbenzyl)piperazino]methyl]coumarin Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC4=CC=CC(=C4)C

InChI

InChI=1S/C24H28N2O3/c1-3-28-21-7-8-23-22(15-21)20(14-24(27)29-23)17-26-11-9-25(10-12-26)16-19-6-4-5-18(2)13-19/h4-8,13-15H,3,9-12,16-17H2,1-2H3