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

Systemtic Name: 4-methyl-7-(2-methylprop-2-enoxy)-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]chromen-2-one Openeye Name: 4-methyl-7-(2-methylallyloxy)-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]chromen-2-one CAS Name: 4-methyl-7-(2-methylprop-2-enoxy)-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(2-methylprop-2-enoxy)-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]chromen-2-one Traditional Name: 3-[3-keto-3-(4-phenylpiperazino)propyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4/c1-19(2)18-32-22-9-10-23-20(3)24(27(31)33-25(23)17-22)11-12-26(30)29-15-13-28(14-16-29)21-7-5-4-6-8-21/h4-10,17H,1,11-16,18H2,2-3H3