3-(azepan-1-ylcarbonyl)-8-ethoxy-chromen-2-one

Systemtic Name: 3-(azepan-1-ylcarbonyl)-8-ethoxy-chromen-2-one Openeye Name: 3-(azepane-1-carbonyl)-8-ethoxy-chromen-2-one CAS Name: 3-[1-azepanyl(oxo)methyl]-8-ethoxy-1-benzopyran-2-one IUPAC Name: 3-(azepane-1-carbonyl)-8-ethoxychromen-2-one Traditional Name: 3-(azepane-1-carbonyl)-8-ethoxy-coumarin Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C18H21NO4/c1-2-22-15-9-7-8-13-12-14(18(21)23-16(13)15)17(20)19-10-5-3-4-6-11-19/h7-9,12H,2-6,10-11H2,1H3