4,8-dimethyl-7-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)chromen-2-one

Systemtic Name: 4,8-dimethyl-7-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)chromen-2-one Openeye Name: 4,8-dimethyl-7-(2-morpholinosulfonyl-4-nitro-phenoxy)chromen-2-one CAS Name: 4,8-dimethyl-7-[2-(4-morpholinylsulfonyl)-4-nitrophenoxy]-1-benzopyran-2-one IUPAC Name: 4,8-dimethyl-7-(2-morpholin-4-ylsulfonyl-4-nitrophenoxy)chromen-2-one Traditional Name: 4,8-dimethyl-7-(2-morpholinosulfonyl-4-nitro-phenoxy)coumarin Formula: C21H20N2O8S MolecularWeight: 460.4571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H20N2O8S/c1-13-11-20(24)31-21-14(2)17(6-4-16(13)21)30-18-5-3-15(23(25)26)12-19(18)32(27,28)22-7-9-29-10-8-22/h3-6,11-12H,7-10H2,1-2H3