2-[2,6,6-trimethyl-1-(4-nitrophenyl)-4-oxidanylidene-5,7-dihydroindol-3-yl]ethanoic acid

Systemtic Name: 2-[2,6,6-trimethyl-1-(4-nitrophenyl)-4-oxidanylidene-5,7-dihydroindol-3-yl]ethanoic acid Openeye Name: 2-[2,6,6-trimethyl-1-(4-nitrophenyl)-4-oxo-5,7-dihydroindol-3-yl]acetic acid CAS Name: 2-[2,6,6-trimethyl-1-(4-nitrophenyl)-4-oxo-5,7-dihydroindol-3-yl]acetic acid IUPAC Name: 2-[2,6,6-trimethyl-1-(4-nitrophenyl)-4-oxo-5,7-dihydroindol-3-yl]acetic acid Traditional Name: 2-[4-keto-2,6,6-trimethyl-1-(4-nitrophenyl)-5,7-dihydroindol-3-yl]acetic acid Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)[N+](=O)[O-])CC(CC2=O)(C)C)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)[N+](=O)[O-])CC(CC2=O)(C)C)CC(=O)O

InChI

InChI=1S/C19H20N2O5/c1-11-14(8-17(23)24)18-15(9-19(2,3)10-16(18)22)20(11)12-4-6-13(7-5-12)21(25)26/h4-7H,8-10H2,1-3H3,(H,23,24)