4-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 4-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[4-(azepane-1-carbonyl)piperidino]methyl]-6-isopropyl-7-methyl-coumarin Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(=O)N4CCCCCC4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(=O)N4CCCCCC4)C(C)C

InChI

InChI=1S/C26H36N2O3/c1-18(2)22-16-23-21(15-25(29)31-24(23)14-19(22)3)17-27-12-8-20(9-13-27)26(30)28-10-6-4-5-7-11-28/h14-16,18,20H,4-13,17H2,1-3H3