5-[5-(2-methoxy-2-oxidanylidene-ethyl)-7-nitro-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[5-(2-methoxy-2-oxidanylidene-ethyl)-7-nitro-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[5-(2-methoxy-2-oxo-ethyl)-7-nitro-indolin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[5-(2-methoxy-2-oxoethyl)-7-nitro-2,3-dihydroindol-1-yl]-5-oxopentanoic acid IUPAC Name: 5-[5-(2-methoxy-2-oxoethyl)-7-nitro-2,3-dihydroindol-1-yl]-5-oxopentanoic acid Traditional Name: 5-keto-5-[5-(2-keto-2-methoxy-ethyl)-7-nitro-indolin-1-yl]valeric acid Formula: C16H18N2O7 MolecularWeight: 350.32332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=C2C(=C1)CCN2C(=O)CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CC(=C2C(=C1)CCN2C(=O)CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O7/c1-25-15(22)9-10-7-11-5-6-17(13(19)3-2-4-14(20)21)16(11)12(8-10)18(23)24/h7-8H,2-6,9H2,1H3,(H,20,21)