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

Systemtic Name: 4-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[4-(azepane-1-carbonyl)piperidino]methyl]-7-methoxy-coumarin Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H30N2O4/c1-28-19-6-7-20-18(14-22(26)29-21(20)15-19)16-24-12-8-17(9-13-24)23(27)25-10-4-2-3-5-11-25/h6-7,14-15,17H,2-5,8-13,16H2,1H3