4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[2-(azepan-1-yl)-2-oxo-ethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[2-(1-azepanyl)-2-oxoethyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[2-(azepan-1-yl)-2-oxoethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[2-(azepan-1-yl)-2-keto-ethyl]-6,7-dimethyl-coumarin Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)N3CCCCCC3)C

InChI

InChI=1S/C19H23NO3/c1-13-9-16-15(12-19(22)23-17(16)10-14(13)2)11-18(21)20-7-5-3-4-6-8-20/h9-10,12H,3-8,11H2,1-2H3