(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H20ClNO5 MolecularWeight: 377.8188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN3CCCCCC3=O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN3CCCCCC3=O)Cl

InChI

InChI=1S/C19H20ClNO5/c1-12-7-16-14(9-15(12)20)13(8-18(23)26-16)11-25-19(24)10-21-6-4-2-3-5-17(21)22/h7-9H,2-6,10-11H2,1H3