2-methyl-5-(4-nitrophenyl)-1-propan-2-yl-pyrrole-3-carboxylic acid

Systemtic Name: 2-methyl-5-(4-nitrophenyl)-1-propan-2-yl-pyrrole-3-carboxylic acid Openeye Name: 1-isopropyl-2-methyl-5-(4-nitrophenyl)pyrrole-3-carboxylic acid CAS Name: 2-methyl-5-(4-nitrophenyl)-1-propan-2-yl-3-pyrrolecarboxylic acid IUPAC Name: 2-methyl-5-(4-nitrophenyl)-1-propan-2-ylpyrrole-3-carboxylic acid Traditional Name: 1-isopropyl-2-methyl-5-(4-nitrophenyl)pyrrole-3-carboxylic acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C(C)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C=C(N1C(C)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H16N2O4/c1-9(2)16-10(3)13(15(18)19)8-14(16)11-4-6-12(7-5-11)17(20)21/h4-9H,1-3H3,(H,18,19)