2-[5-methoxy-2-methyl-1-(5-nitrofuran-2-yl)carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(5-nitrofuran-2-yl)carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-1-(5-nitrofuran-2-carbonyl)indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-[(5-nitro-2-furanyl)-oxomethyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(5-nitrofuran-2-carbonyl)indol-3-yl]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-1-(5-nitro-2-furoyl)indol-3-yl]acetic acid Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(O3)[N+](=O)[O-])C=CC(=C2)OC)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(O3)[N+](=O)[O-])C=CC(=C2)OC)CC(=O)O

InChI

InChI=1S/C17H14N2O7/c1-9-11(8-16(20)21)12-7-10(25-2)3-4-13(12)18(9)17(22)14-5-6-15(26-14)19(23)24/h3-7H,8H2,1-2H3,(H,20,21)