6-chloranyl-7-ethyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-ethyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]chromen-2-one Openeye Name: 6-chloro-7-ethyl-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-chloro-7-ethyl-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-ethyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]chromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[4-(2-pyridyl)piperazino]methyl]coumarin Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)C4=CC=CC=N4)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)C4=CC=CC=N4)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-2-15-11-19-17(13-18(15)22)16(12-21(26)27-19)14-24-7-9-25(10-8-24)20-5-3-4-6-23-20/h3-6,11-13H,2,7-10,14H2,1H3