2-[(4-azido-2-nitro-phenyl)amino]-2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butanoate

Systemtic Name: 2-[(4-azido-2-nitro-phenyl)amino]-2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butanoate Openeye Name: 2-(4-azido-2-nitro-anilino)-2-(2,5-dioxopyrrolidin-1-yl)butanoate CAS Name: 2-(4-azido-2-nitroanilino)-2-(2,5-dioxo-1-pyrrolidinyl)butanoate IUPAC Name: 2-(4-azido-2-nitroanilino)-2-(2,5-dioxopyrrolidin-1-yl)butanoate Traditional Name: 2-(4-azido-2-nitro-anilino)-2-succinimido-butyrate Formula: C14H13N6O6- MolecularWeight: 361.28962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])(NC1=C(C=C(C=C1)N=[N+]=[N-])[N+](=O)[O-])N2C(=O)CCC2=O

Isomeric SMILES

CCC(C(=O)[O-])(NC1=C(C=C(C=C1)N=[N+]=[N-])[N+](=O)[O-])N2C(=O)CCC2=O

InChI

InChI=1S/C14H14N6O6/c1-2-14(13(23)24,19-11(21)5-6-12(19)22)16-9-4-3-8(17-18-15)7-10(9)20(25)26/h3-4,7,16H,2,5-6H2,1H3,(H,23,24)/p-1