5-methyl-2-nitro-4-propan-2-yl-N-[(E)-prop-1-enyl]aniline

Systemtic Name: 5-methyl-2-nitro-4-propan-2-yl-N-[(E)-prop-1-enyl]aniline Openeye Name: 4-isopropyl-5-methyl-2-nitro-N-[(E)-prop-1-enyl]aniline CAS Name: 5-methyl-2-nitro-4-propan-2-yl-N-[(E)-prop-1-enyl]aniline IUPAC Name: 5-methyl-2-nitro-4-propan-2-yl-N-[(E)-prop-1-enyl]aniline Traditional Name: (4-isopropyl-5-methyl-2-nitro-phenyl)-[(E)-prop-1-enyl]amine Formula: C13H18N2O2 MolecularWeight: 234.29422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CNC1=C(C=C(C(=C1)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

C/C=C/NC1=C(C=C(C(=C1)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O2/c1-5-6-14-12-7-10(4)11(9(2)3)8-13(12)15(16)17/h5-9,14H,1-4H3/b6-5+