1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid

Systemtic Name: 1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid Openeye Name: 1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid CAS Name: 1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid IUPAC Name: 1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid Traditional Name: 1-methyl-3-(4-nitrophenyl)cyclobutane-1,3-dicarboxylic acid Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O

Isomeric SMILES

CC1(CC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O

InChI

InChI=1S/C13H13NO6/c1-12(10(15)16)6-13(7-12,11(17)18)8-2-4-9(5-3-8)14(19)20/h2-5H,6-7H2,1H3,(H,15,16)(H,17,18)