2-bromanyl-5,5-dimethyl-3-[(2-nitrophenyl)amino]cyclohex-2-en-1-one

Systemtic Name: 2-bromanyl-5,5-dimethyl-3-[(2-nitrophenyl)amino]cyclohex-2-en-1-one Openeye Name: 2-bromo-5,5-dimethyl-3-(2-nitroanilino)cyclohex-2-en-1-one CAS Name: 2-bromo-5,5-dimethyl-3-(2-nitroanilino)-1-cyclohex-2-enone IUPAC Name: 2-bromo-5,5-dimethyl-3-(2-nitroanilino)cyclohex-2-en-1-one Traditional Name: 2-bromo-5,5-dimethyl-3-(2-nitroanilino)cyclohex-2-en-1-one Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)Br)NC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)Br)NC2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C14H15BrN2O3/c1-14(2)7-10(13(15)12(18)8-14)16-9-5-3-4-6-11(9)17(19)20/h3-6,16H,7-8H2,1-2H3