5,5-dimethyl-3-[(4-nitrophenyl)amino]cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-[(4-nitrophenyl)amino]cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-3-(4-nitroanilino)cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-(4-nitroanilino)-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-3-(4-nitroanilino)cyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-3-(4-nitroanilino)cyclohex-2-en-1-one Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3/c1-14(2)8-11(7-13(17)9-14)15-10-3-5-12(6-4-10)16(18)19/h3-7,15H,8-9H2,1-2H3