2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-6-chloranyl-chromen-4-one

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-6-chloranyl-chromen-4-one Openeye Name: 2-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-6-chloro-chromen-4-one CAS Name: 2-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-6-chloro-1-benzopyran-4-one IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-6-chlorochromen-4-one Traditional Name: 2-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-6-chloro-chromone Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C22H25ClN2O4/c23-16-5-6-19-17(13-16)18(26)14-20(29-19)22(28)25-11-7-15(8-12-25)21(27)24-9-3-1-2-4-10-24/h5-6,13-15H,1-4,7-12H2