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

Systemtic Name: 6-chloranyl-7-methyl-4-[(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[(4-morpholinosulfonyl-2-nitro-phenoxy)methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(4-morpholinosulfonyl-2-nitro-phenoxy)methyl]coumarin Formula: C21H19ClN2O8S MolecularWeight: 494.90216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H19ClN2O8S/c1-13-8-20-16(11-17(13)22)14(9-21(25)32-20)12-31-19-3-2-15(10-18(19)24(26)27)33(28,29)23-4-6-30-7-5-23/h2-3,8-11H,4-7,12H2,1H3