methyl 4-(5-nitro-2-oxidanylidene-3H-indol-1-yl)butanoate

Systemtic Name: methyl 4-(5-nitro-2-oxidanylidene-3H-indol-1-yl)butanoate Openeye Name: methyl 4-(5-nitro-2-oxo-indolin-1-yl)butanoate CAS Name: 4-(5-nitro-2-oxo-3H-indol-1-yl)butanoic acid methyl ester IUPAC Name: methyl 4-(5-nitro-2-oxo-3H-indol-1-yl)butanoate Traditional Name: 4-(2-keto-5-nitro-indolin-1-yl)butyric acid methyl ester Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C(=O)CC2=C1C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCN1C(=O)CC2=C1C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5/c1-20-13(17)3-2-6-14-11-5-4-10(15(18)19)7-9(11)8-12(14)16/h4-5,7H,2-3,6,8H2,1H3