4-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-7-ethyl-chromen-2-one Openeye Name: 4-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-7-ethyl-chromen-2-one CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-7-ethylchromen-2-one Traditional Name: 4-[[4-(azepane-1-carbonyl)piperidino]methyl]-7-ethyl-coumarin Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C24H32N2O3/c1-2-18-7-8-21-20(16-23(27)29-22(21)15-18)17-25-13-9-19(10-14-25)24(28)26-11-5-3-4-6-12-26/h7-8,15-16,19H,2-6,9-14,17H2,1H3