8-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-7-propoxy-chromen-2-one

Systemtic Name: 8-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-7-propoxy-chromen-2-one Openeye Name: 8-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]-7-propoxy-chromen-2-one CAS Name: 8-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-7-propoxy-1-benzopyran-2-one IUPAC Name: 8-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-7-propoxychromen-2-one Traditional Name: 8-[[4-[(E)-cinnamyl]piperazino]methyl]-7-propoxy-coumarin Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=C1)C=CC(=O)O2)CN3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CCCOC1=C(C2=C(C=C1)C=CC(=O)O2)CN3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O3/c1-2-19-30-24-12-10-22-11-13-25(29)31-26(22)23(24)20-28-17-15-27(16-18-28)14-6-9-21-7-4-3-5-8-21/h3-13H,2,14-20H2,1H3/b9-6+