(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C23H23NO7S MolecularWeight: 457.49622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C23H23NO7S/c1-15-6-7-20-18(13-21(25)31-22(20)16(15)2)14-30-23(26)17-4-3-5-19(12-17)32(27,28)24-8-10-29-11-9-24/h3-7,12-13H,8-11,14H2,1-2H3