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

Systemtic Name: 6-chloranyl-4-methyl-7-(2-methylprop-2-enoxy)-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one Openeye Name: 6-chloro-4-methyl-7-(2-methylallyloxy)-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one CAS Name: 6-chloro-4-methyl-7-(2-methylprop-2-enoxy)-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-(2-methylprop-2-enoxy)-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one Traditional Name: 6-chloro-3-[2-keto-2-(4-phenylpiperazino)ethyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C26H27ClN2O4 MolecularWeight: 466.95658

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H27ClN2O4/c1-17(2)16-32-24-15-23-20(13-22(24)27)18(3)21(26(31)33-23)14-25(30)29-11-9-28(10-12-29)19-7-5-4-6-8-19/h4-8,13,15H,1,9-12,14,16H2,2-3H3