5-[5-nitro-2,3-bis(oxidanylidene)indol-1-yl]pentanoate

Systemtic Name: 5-[5-nitro-2,3-bis(oxidanylidene)indol-1-yl]pentanoate Openeye Name: 5-(5-nitro-2,3-dioxo-indolin-1-yl)pentanoate CAS Name: 5-(5-nitro-2,3-dioxo-1-indolyl)pentanoate IUPAC Name: 5-(5-nitro-2,3-dioxoindol-1-yl)pentanoate Traditional Name: 5-(2,3-diketo-5-nitro-indolin-1-yl)valerate Formula: C13H11N2O6- MolecularWeight: 291.23624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCCCC(=O)[O-]

InChI

InChI=1S/C13H12N2O6/c16-11(17)3-1-2-6-14-10-5-4-8(15(20)21)7-9(10)12(18)13(14)19/h4-5,7H,1-3,6H2,(H,16,17)/p-1