3-[(E)-2-(dimethylamino)ethenyl]-2,6-dinitro-N-pentan-3-yl-4-propan-2-yl-aniline

Systemtic Name: 3-[(E)-2-(dimethylamino)ethenyl]-2,6-dinitro-N-pentan-3-yl-4-propan-2-yl-aniline Openeye Name: 3-[(E)-2-(dimethylamino)vinyl]-N-(1-ethylpropyl)-4-isopropyl-2,6-dinitro-aniline CAS Name: 3-[(E)-2-(dimethylamino)ethenyl]-2,6-dinitro-N-pentan-3-yl-4-propan-2-ylaniline IUPAC Name: 3-[(E)-2-(dimethylamino)ethenyl]-2,6-dinitro-N-pentan-3-yl-4-propan-2-ylaniline Traditional Name: [(E)-2-[3-(1-ethylpropylamino)-6-isopropyl-2,4-dinitro-phenyl]vinyl]-dimethyl-amine Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C=CN(C)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O4/c1-7-13(8-2)19-17-16(21(23)24)11-15(12(3)4)14(9-10-20(5)6)18(17)22(25)26/h9-13,19H,7-8H2,1-6H3/b10-9+