2-chloranyl-2-(4-cyclohexyl-3-methyl-5-nitro-phenyl)ethanoic acid

Systemtic Name: 2-chloranyl-2-(4-cyclohexyl-3-methyl-5-nitro-phenyl)ethanoic acid Openeye Name: 2-chloro-2-(4-cyclohexyl-3-methyl-5-nitro-phenyl)acetic acid CAS Name: 2-chloro-2-(4-cyclohexyl-3-methyl-5-nitrophenyl)acetic acid IUPAC Name: 2-chloro-2-(4-cyclohexyl-3-methyl-5-nitrophenyl)acetic acid Traditional Name: 2-chloro-2-(4-cyclohexyl-3-methyl-5-nitro-phenyl)acetic acid Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C(=O)O)Cl)[N+](=O)[O-])C2CCCCC2

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C(=O)O)Cl)[N+](=O)[O-])C2CCCCC2

InChI

InChI=1S/C15H18ClNO4/c1-9-7-11(14(16)15(18)19)8-12(17(20)21)13(9)10-5-3-2-4-6-10/h7-8,10,14H,2-6H2,1H3,(H,18,19)