7-methyl-4-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methyl-4-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-methyl-4-[[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-methyl-4-[[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 4-[[4-(2-keto-2-pyrrolidino-ethyl)piperazino]methyl]-7-methyl-coumarin Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C21H27N3O3/c1-16-4-5-18-17(13-21(26)27-19(18)12-16)14-22-8-10-23(11-9-22)15-20(25)24-6-2-3-7-24/h4-5,12-13H,2-3,6-11,14-15H2,1H3