4-[(2-chloranyl-4-nitro-phenoxy)methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(2-chloranyl-4-nitro-phenoxy)methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7-hydroxy-8-methyl-coumarin Formula: C17H12ClNO6 MolecularWeight: 361.73328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C17H12ClNO6/c1-9-14(20)4-3-12-10(6-16(21)25-17(9)12)8-24-15-5-2-11(19(22)23)7-13(15)18/h2-7,20H,8H2,1H3