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

Systemtic Name: 6-ethoxy-4-[[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-ethoxy-4-[[3-methyl-4-(m-tolyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethoxy-4-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethoxy-4-[[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethoxy-4-[[3-methyl-4-(m-tolyl)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(C(C3)C)C4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(C(C3)C)C4=CC=CC(=C4)C

InChI

InChI=1S/C24H28N2O3/c1-4-28-21-8-9-23-22(14-21)19(13-24(27)29-23)16-25-10-11-26(18(3)15-25)20-7-5-6-17(2)12-20/h5-9,12-14,18H,4,10-11,15-16H2,1-3H3