(2-ethyl-5-nitro-phenyl)-(3-iodanylphenyl)methanamine

Systemtic Name: (2-ethyl-5-nitro-phenyl)-(3-iodanylphenyl)methanamine Openeye Name: (2-ethyl-5-nitro-phenyl)-(3-iodophenyl)methanamine CAS Name: (2-ethyl-5-nitrophenyl)-(3-iodophenyl)methanamine IUPAC Name: (2-ethyl-5-nitrophenyl)-(3-iodophenyl)methanamine Traditional Name: [(2-ethyl-5-nitro-phenyl)-(3-iodophenyl)methyl]amine Formula: C15H15IN2O2 MolecularWeight: 382.19627

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CC=C2)I)N

Isomeric SMILES

CCC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CC=C2)I)N

InChI

InChI=1S/C15H15IN2O2/c1-2-10-6-7-13(18(19)20)9-14(10)15(17)11-4-3-5-12(16)8-11/h3-9,15H,2,17H2,1H3