(1R,6R)-6-[(2-bromanyl-4-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-[(2-bromanyl-4-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-[(2-bromo-4-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[(2-bromo-4-methylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-[(2-bromo-4-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[(2-bromo-4-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C15H15BrNO3- MolecularWeight: 337.1885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CC=CCC2C(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])Br

InChI

InChI=1S/C15H16BrNO3/c1-9-6-7-13(12(16)8-9)17-14(18)10-4-2-3-5-11(10)15(19)20/h2-3,6-8,10-11H,4-5H2,1H3,(H,17,18)(H,19,20)/p-1/t10-,11-/m1/s1