8-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-3-ethyl-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 8-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-3-ethyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 8-[[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methyl]-3-ethyl-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]methyl]-3-ethyl-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 8-[[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl]-3-ethyl-7-hydroxy-4-methylchromen-2-one Traditional Name: 8-[[4-(5-chloro-2-methyl-phenyl)piperazino]methyl]-3-ethyl-7-hydroxy-4-methyl-coumarin Formula: C24H27ClN2O3 MolecularWeight: 426.93578

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C(C=C2)O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)OC1=O)C

Isomeric SMILES

CCC1=C(C2=C(C(=C(C=C2)O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)OC1=O)C

InChI

InChI=1S/C24H27ClN2O3/c1-4-18-16(3)19-7-8-22(28)20(23(19)30-24(18)29)14-26-9-11-27(12-10-26)21-13-17(25)6-5-15(21)2/h5-8,13,28H,4,9-12,14H2,1-3H3