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

Systemtic Name: 6-chloranyl-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Openeye Name: 6-chloro-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-4-methyl-7-(2-methylallyloxy)chromen-2-one CAS Name: 6-chloro-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)-1-benzopyran-2-one IUPAC Name: 6-chloro-3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Traditional Name: 6-chloro-3-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C27H29ClN2O5 MolecularWeight: 496.98256

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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)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)C)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H29ClN2O5/c1-17(2)16-34-25-15-24-21(13-23(25)28)18(3)22(27(32)35-24)14-26(31)30-11-9-29(10-12-30)19-5-7-20(33-4)8-6-19/h5-8,13,15H,1,9-12,14,16H2,2-4H3