(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-methyl-3-nitro-benzoate

Systemtic Name: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-methyl-3-nitro-benzoate Openeye Name: (1,7,7-trimethylnorbornan-2-yl) 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) ester IUPAC Name: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid 2-bornyl ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC2CC3CCC2(C3(C)C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC2CC3CCC2(C3(C)C)C

InChI

InChI=1S/C18H23NO4/c1-11-13(6-5-7-14(11)19(21)22)16(20)23-15-10-12-8-9-18(15,4)17(12,2)3/h5-7,12,15H,8-10H2,1-4H3