1-[10-(2-carboxy-4-nitro-pyrrol-1-yl)decyl]-4-nitro-pyrrole-2-carboxylic acid

Systemtic Name: 1-[10-(2-carboxy-4-nitro-pyrrol-1-yl)decyl]-4-nitro-pyrrole-2-carboxylic acid Openeye Name: 1-[10-(2-carboxy-4-nitro-pyrrol-1-yl)decyl]-4-nitro-pyrrole-2-carboxylic acid CAS Name: 1-[10-(2-carboxy-4-nitro-1-pyrrolyl)decyl]-4-nitro-2-pyrrolecarboxylic acid IUPAC Name: 1-[10-(2-carboxy-4-nitropyrrol-1-yl)decyl]-4-nitropyrrole-2-carboxylic acid Traditional Name: 1-[10-(2-carboxy-4-nitro-pyrrol-1-yl)decyl]-4-nitro-pyrrole-2-carboxylic acid Formula: C20H26N4O8 MolecularWeight: 450.44244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(N(C=C1[N+](=O)[O-])CCCCCCCCCCN2C=C(C=C2C(=O)O)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=C(N(C=C1[N+](=O)[O-])CCCCCCCCCCN2C=C(C=C2C(=O)O)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H26N4O8/c25-19(26)17-11-15(23(29)30)13-21(17)9-7-5-3-1-2-4-6-8-10-22-14-16(24(31)32)12-18(22)20(27)28/h11-14H,1-10H2,(H,25,26)(H,27,28)