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

Systemtic Name: 4-[(2-chloranyl-4-nitro-phenoxy)methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[(2-chloro-4-nitrophenoxy)methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[(2-chloro-4-nitro-phenoxy)methyl]-7,8-dimethyl-coumarin Formula: C18H14ClNO5 MolecularWeight: 359.76046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H14ClNO5/c1-10-3-5-14-12(7-17(21)25-18(14)11(10)2)9-24-16-6-4-13(20(22)23)8-15(16)19/h3-8H,9H2,1-2H3