N-methylmethanamine; (E)-N1-methyl-2-nitro-N1'-[4-(3-propylphenoxy)butyl]ethene-1,1-diamine

Systemtic Name: N-methylmethanamine; (E)-N1-methyl-2-nitro-N1'-[4-(3-propylphenoxy)butyl]ethene-1,1-diamine Openeye Name: N-methylmethanamine; (E)-N1-methyl-2-nitro-N1'-[4-(3-propylphenoxy)butyl]ethene-1,1-diamine CAS Name: N-methylmethanamine; (E)-N1-methyl-2-nitro-N1'-[4-(3-propylphenoxy)butyl]ethene-1,1-diamine IUPAC Name: N-methylmethanamine; (E)-1-N-methyl-2-nitro-1-N'-[4-(3-propylphenoxy)butyl]ethene-1,1-diamine Traditional Name: dimethylamine; methyl-[(E)-2-nitro-1-[4-(3-propylphenoxy)butylamino]vinyl]amine Formula: C18H32N4O3 MolecularWeight: 352.47168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC=C1)OCCCCNC(=C[N+](=O)[O-])NC.CNC

Isomeric SMILES

CCCC1=CC(=CC=C1)OCCCCN/C(=C/[N+](=O)[O-])/NC.CNC

InChI

InChI=1S/C16H25N3O3.C2H7N/c1-3-7-14-8-6-9-15(12-14)22-11-5-4-10-18-16(17-2)13-19(20)21;1-3-2/h6,8-9,12-13,17-18H,3-5,7,10-11H2,1-2H3;3H,1-2H3/b16-13+;