N-methylmethanamine; 2-nitro-3-phenyl-N-propyl-1-benzofuran-7-carboxamide

Systemtic Name: N-methylmethanamine; 2-nitro-3-phenyl-N-propyl-1-benzofuran-7-carboxamide Openeye Name: N-methylmethanamine; 2-nitro-3-phenyl-N-propyl-benzofuran-7-carboxamide CAS Name: N-methylmethanamine; 2-nitro-3-phenyl-N-propyl-7-benzofurancarboxamide IUPAC Name: N-methylmethanamine; 2-nitro-3-phenyl-N-propyl-1-benzofuran-7-carboxamide Traditional Name: dimethylamine; 2-nitro-3-phenyl-N-propyl-benzofuran-7-carboxamide Formula: C20H23N3O4 MolecularWeight: 369.41432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC2=C1OC(=C2C3=CC=CC=C3)[N+](=O)[O-].CNC

Isomeric SMILES

CCCNC(=O)C1=CC=CC2=C1OC(=C2C3=CC=CC=C3)[N+](=O)[O-].CNC

InChI

InChI=1S/C18H16N2O4.C2H7N/c1-2-11-19-17(21)14-10-6-9-13-15(12-7-4-3-5-8-12)18(20(22)23)24-16(13)14;1-3-2/h3-10H,2,11H2,1H3,(H,19,21);3H,1-2H3