6-chloranyl-4-methyl-7-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)chromen-2-one Openeye Name: 6-chloro-4-methyl-7-(2-morpholinosulfonyl-4-nitro-phenoxy)chromen-2-one CAS Name: 6-chloro-4-methyl-7-[2-(4-morpholinylsulfonyl)-4-nitrophenoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-(2-morpholin-4-ylsulfonyl-4-nitrophenoxy)chromen-2-one Traditional Name: 6-chloro-4-methyl-7-(2-morpholinosulfonyl-4-nitro-phenoxy)coumarin Formula: C20H17ClN2O8S MolecularWeight: 480.87558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H17ClN2O8S/c1-12-8-20(24)31-17-11-18(15(21)10-14(12)17)30-16-3-2-13(23(25)26)9-19(16)32(27,28)22-4-6-29-7-5-22/h2-3,8-11H,4-7H2,1H3