6-chloranyl-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one

Systemtic Name: 6-chloranyl-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Openeye Name: 6-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxo-ethyl]-4-methyl-7-(2-methylallyloxy)chromen-2-one CAS Name: 6-chloro-3-[2-[4-(2-hydroxyethyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)-1-benzopyran-2-one IUPAC Name: 6-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Traditional Name: 6-chloro-3-[2-[4-(2-hydroxyethyl)piperazino]-2-keto-ethyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C22H27ClN2O5 MolecularWeight: 434.91318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)C)CC(=O)N3CCN(CC3)CCO

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)C)CC(=O)N3CCN(CC3)CCO

InChI

InChI=1S/C22H27ClN2O5/c1-14(2)13-29-20-12-19-16(10-18(20)23)15(3)17(22(28)30-19)11-21(27)25-6-4-24(5-7-25)8-9-26/h10,12,26H,1,4-9,11,13H2,2-3H3