3-[2-(4-methoxy-3-nitro-phenyl)ethanoyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[2-(4-methoxy-3-nitro-phenyl)ethanoyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-3-[2-(4-methoxy-3-nitro-phenyl)acetyl]chromen-2-one CAS Name: 7-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)acetyl]chromen-2-one Traditional Name: 7-hydroxy-3-[2-(4-methoxy-3-nitro-phenyl)acetyl]coumarin Formula: C18H13NO7 MolecularWeight: 355.29832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)C2=CC3=C(C=C(C=C3)O)OC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)C2=CC3=C(C=C(C=C3)O)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H13NO7/c1-25-16-5-2-10(6-14(16)19(23)24)7-15(21)13-8-11-3-4-12(20)9-17(11)26-18(13)22/h2-6,8-9,20H,7H2,1H3