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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

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