methyl (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylate

Systemtic Name: methyl (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylate Openeye Name: methyl (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylate CAS Name: (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylate Traditional Name: (1S,1aR,7bR)-1-nitro-1a,2,3,7b-tetrahydrocyclopropa[a]naphthalene-1-carboxylic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2C1C3=CC=CC=C3CC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@]1([C@H]2[C@@H]1C3=CC=CC=C3CC2)[N+](=O)[O-]

InChI

InChI=1S/C13H13NO4/c1-18-12(15)13(14(16)17)10-7-6-8-4-2-3-5-9(8)11(10)13/h2-5,10-11H,6-7H2,1H3/t10-,11+,13+/m1/s1