3-(2,3-dimethylphenyl)-2-methylidene-1-(3-nitrophenyl)dodecan-1-one

Systemtic Name: 3-(2,3-dimethylphenyl)-2-methylidene-1-(3-nitrophenyl)dodecan-1-one Openeye Name: 3-(2,3-dimethylphenyl)-2-methylene-1-(3-nitrophenyl)dodecan-1-one CAS Name: 3-(2,3-dimethylphenyl)-2-methylene-1-(3-nitrophenyl)-1-dodecanone IUPAC Name: 3-(2,3-dimethylphenyl)-2-methylidene-1-(3-nitrophenyl)dodecan-1-one Traditional Name: 2-[1-(2,3-dimethylphenyl)decyl]-1-(3-nitrophenyl)prop-2-en-1-one Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1=CC=CC(=C1C)C)C(=C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCC(C1=CC=CC(=C1C)C)C(=C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C27H35NO3/c1-5-6-7-8-9-10-11-17-26(25-18-12-14-20(2)21(25)3)22(4)27(29)23-15-13-16-24(19-23)28(30)31/h12-16,18-19,26H,4-11,17H2,1-3H3