5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-[(4-nitrophenyl)methyl]pyrrole-3-carboxylic acid

Systemtic Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-[(4-nitrophenyl)methyl]pyrrole-3-carboxylic acid Openeye Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-[(4-nitrophenyl)methyl]pyrrole-3-carboxylic acid CAS Name: 5-[2-(4-methoxyphenyl)-4-thiazolyl]-2-methyl-1-[(4-nitrophenyl)methyl]-3-pyrrolecarboxylic acid IUPAC Name: 5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-2-methyl-1-[(4-nitrophenyl)methyl]pyrrole-3-carboxylic acid Traditional Name: 5-[2-(4-methoxyphenyl)thiazol-4-yl]-2-methyl-1-(4-nitrobenzyl)pyrrole-3-carboxylic acid Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C3=CSC(=N3)C4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C23H19N3O5S/c1-14-19(23(27)28)11-21(25(14)12-15-3-7-17(8-4-15)26(29)30)20-13-32-22(24-20)16-5-9-18(31-2)10-6-16/h3-11,13H,12H2,1-2H3,(H,27,28)