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

Systemtic Name: 4-[(2-chloranyl-4-nitro-phenoxy)methyl]-7-methyl-chromen-2-one Openeye Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7-methyl-chromen-2-one CAS Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7-methylchromen-2-one Traditional Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7-methyl-coumarin Formula: C17H12ClNO5 MolecularWeight: 345.73388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClNO5/c1-10-2-4-13-11(7-17(20)24-16(13)6-10)9-23-15-5-3-12(19(21)22)8-14(15)18/h2-8H,9H2,1H3