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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC=CC=N4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC=CC=N4)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-15-10-20-18(12-19(15)22)16(11-21(26)27-20)13-24-6-8-25(9-7-24)14-17-4-2-3-5-23-17/h2-5,10-12H,6-9,13-14H2,1H3