3-[1-(4-chloranyl-2-nitro-phenyl)pyrrol-2-yl]-4-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3-[1-(4-chloranyl-2-nitro-phenyl)pyrrol-2-yl]-4-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-[1-(4-chloro-2-nitro-phenyl)pyrrol-2-yl]-4-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-[1-(4-chloro-2-nitrophenyl)-2-pyrrolyl]-4-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-[1-(4-chloro-2-nitrophenyl)pyrrol-2-yl]-4-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 3-[1-(4-chloro-2-nitro-phenyl)pyrrol-2-yl]-4-methyl-1H-pyrrole-2-carboxylic acid Formula: C16H12ClN3O4 MolecularWeight: 345.73718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=C1C2=CC=CN2C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CNC(=C1C2=CC=CN2C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H12ClN3O4/c1-9-8-18-15(16(21)22)14(9)12-3-2-6-19(12)11-5-4-10(17)7-13(11)20(23)24/h2-8,18H,1H3,(H,21,22)