1-[(E)-2-(4,5-dimethylcyclohexa-1,4-dien-1-yl)ethenyl]-3-nitro-benzene

Systemtic Name: 1-[(E)-2-(4,5-dimethylcyclohexa-1,4-dien-1-yl)ethenyl]-3-nitro-benzene Openeye Name: 1-[(E)-2-(4,5-dimethylcyclohexa-1,4-dien-1-yl)vinyl]-3-nitro-benzene CAS Name: 1-[(E)-2-(4,5-dimethyl-1-cyclohexa-1,4-dienyl)ethenyl]-3-nitrobenzene IUPAC Name: 1-[(E)-2-(4,5-dimethylcyclohexa-1,4-dien-1-yl)ethenyl]-3-nitrobenzene Traditional Name: 1-[(E)-2-(4,5-dimethylcyclohexa-1,4-dien-1-yl)vinyl]-3-nitro-benzene Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=CC1)C=CC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO2/c1-12-6-7-15(10-13(12)2)9-8-14-4-3-5-16(11-14)17(18)19/h3-5,7-9,11H,6,10H2,1-2H3/b9-8+