4-methyl-7-[[4-[4-(2-methylpropanoyl)piperazin-1-yl]carbonylphenyl]methoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[[4-[4-(2-methylpropanoyl)piperazin-1-yl]carbonylphenyl]methoxy]chromen-2-one Openeye Name: 4-methyl-7-[[4-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]methoxy]chromen-2-one CAS Name: 4-methyl-7-[[4-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[[4-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]methoxy]chromen-2-one Traditional Name: 7-[4-(4-isobutyrylpiperazine-1-carbonyl)benzyl]oxy-4-methyl-coumarin Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C(=O)C(C)C

InChI

InChI=1S/C26H28N2O5/c1-17(2)25(30)27-10-12-28(13-11-27)26(31)20-6-4-19(5-7-20)16-32-21-8-9-22-18(3)14-24(29)33-23(22)15-21/h4-9,14-15,17H,10-13,16H2,1-3H3