methyl 3-(3-nitro-2,4-dihydrochromen-3-yl)propanoate

Systemtic Name: methyl 3-(3-nitro-2,4-dihydrochromen-3-yl)propanoate Openeye Name: methyl 3-(3-nitrochroman-3-yl)propanoate CAS Name: 3-(3-nitro-3,4-dihydro-2H-1-benzopyran-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-nitro-2,4-dihydrochromen-3-yl)propanoate Traditional Name: 3-(3-nitrochroman-3-yl)propionic acid methyl ester Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1(CC2=CC=CC=C2OC1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC1(CC2=CC=CC=C2OC1)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO5/c1-18-12(15)6-7-13(14(16)17)8-10-4-2-3-5-11(10)19-9-13/h2-5H,6-9H2,1H3