6-ethyl-7-oxidanyl-4-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-ethyl-7-oxidanyl-4-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[4-(2-phenoxyethyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[4-(2-phenoxyethyl)piperazino]methyl]coumarin Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CCOC4=CC=CC=C4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)CCOC4=CC=CC=C4)O

InChI

InChI=1S/C24H28N2O4/c1-2-18-14-21-19(15-24(28)30-23(21)16-22(18)27)17-26-10-8-25(9-11-26)12-13-29-20-6-4-3-5-7-20/h3-7,14-16,27H,2,8-13,17H2,1H3