4-[[4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-yl]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-yl]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[4-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]piperazin-1-yl]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[4-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-1-piperazinyl]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]piperazin-1-yl]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[4-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]piperazino]methyl]-6,7-dimethyl-coumarin Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC(=O)OC5=CC(=C(C=C45)C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC(=O)OC5=CC(=C(C=C45)C)C)C

InChI

InChI=1S/C28H30N2O4/c1-17-9-23-21(13-27(31)33-25(23)11-19(17)3)15-29-5-7-30(8-6-29)16-22-14-28(32)34-26-12-20(4)18(2)10-24(22)26/h9-14H,5-8,15-16H2,1-4H3