5-nitro-3-[2-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]ethyl]-1H-indole-2-carboxylate

Systemtic Name: 5-nitro-3-[2-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]ethyl]-1H-indole-2-carboxylate Openeye Name: 5-nitro-3-[2-[(4-oxido-4-oxo-butanoyl)amino]ethyl]-1H-indole-2-carboxylate CAS Name: 5-nitro-3-[2-[(4-oxido-1,4-dioxobutyl)amino]ethyl]-1H-indole-2-carboxylate IUPAC Name: 5-nitro-3-[2-[(4-oxido-4-oxobutanoyl)amino]ethyl]-1H-indole-2-carboxylate Traditional Name: 3-[2-[(4-keto-4-oxido-butanoyl)amino]ethyl]-5-nitro-1H-indole-2-carboxylate Formula: C15H13N3O7-2 MolecularWeight: 347.27962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=C(N2)C(=O)[O-])CCNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=C(N2)C(=O)[O-])CCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H15N3O7/c19-12(3-4-13(20)21)16-6-5-9-10-7-8(18(24)25)1-2-11(10)17-14(9)15(22)23/h1-2,7,17H,3-6H2,(H,16,19)(H,20,21)(H,22,23)/p-2