2-butyl-4-nitro-1-(4-prop-1-en-2-ylphenoxy)benzene

Systemtic Name: 2-butyl-4-nitro-1-(4-prop-1-en-2-ylphenoxy)benzene Openeye Name: 2-butyl-1-(4-isopropenylphenoxy)-4-nitro-benzene CAS Name: 2-butyl-1-[4-(1-methylethenyl)phenoxy]-4-nitrobenzene IUPAC Name: 2-butyl-4-nitro-1-(4-prop-1-en-2-ylphenoxy)benzene Traditional Name: 2-butyl-1-(4-isopropenylphenoxy)-4-nitro-benzene Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C(=C)C

Isomeric SMILES

CCCCC1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C(=C)C

InChI

InChI=1S/C19H21NO3/c1-4-5-6-16-13-17(20(21)22)9-12-19(16)23-18-10-7-15(8-11-18)14(2)3/h7-13H,2,4-6H2,1,3H3