methanamine; N-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]ethanamine; dihydrochloride

Systemtic Name: methanamine; N-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]ethanamine; dihydrochloride Openeye Name: methanamine; N-[(2-nitro-3-phenyl-benzofuran-7-yl)methyl]ethanamine; dihydrochloride CAS Name: methanamine; N-[(2-nitro-3-phenyl-7-benzofuranyl)methyl]ethanamine; dihydrochloride IUPAC Name: methanamine; N-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]ethanamine; dihydrochloride Traditional Name: ethyl-[(2-nitro-3-phenyl-benzofuran-7-yl)methyl]amine; methylamine; dihydrochloride Formula: C18H23Cl2N3O3 MolecularWeight: 400.29952

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC=CC2=C1OC(=C2C3=CC=CC=C3)[N+](=O)[O-].CN.Cl.Cl

Isomeric SMILES

CCNCC1=CC=CC2=C1OC(=C2C3=CC=CC=C3)[N+](=O)[O-].CN.Cl.Cl

InChI

InChI=1S/C17H16N2O3.CH5N.2ClH/c1-2-18-11-13-9-6-10-14-15(12-7-4-3-5-8-12)17(19(20)21)22-16(13)14;1-2;;/h3-10,18H,2,11H2,1H3;2H2,1H3;2*1H