tert-butyl-[(3S)-1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium

Systemtic Name: tert-butyl-[(3S)-1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: tert-butyl-[(3S)-1-(4-nitrophenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: tert-butyl-[(3S)-1-(4-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: tert-butyl-[(3S)-1-(4-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: tert-butyl-[(3S)-2,5-diketo-1-(4-nitrophenyl)pyrrolidin-3-yl]ammonium Formula: C14H18N3O4+ MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]C1CC(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)[NH2+][C@H]1CC(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4/c1-14(2,3)15-11-8-12(18)16(13(11)19)9-4-6-10(7-5-9)17(20)21/h4-7,11,15H,8H2,1-3H3/p+1/t11-/m0/s1