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

Systemtic Name: tert-butyl-[(3S)-1-(4-ethoxycarbonylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: tert-butyl-[(3S)-1-(4-ethoxycarbonylphenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: tert-butyl-[(3S)-1-(4-ethoxycarbonylphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: tert-butyl-[(3S)-1-(4-ethoxycarbonylphenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: tert-butyl-[(3S)-1-(4-carbethoxyphenyl)-2,5-diketo-pyrrolidin-3-yl]ammonium Formula: C17H23N2O4+ MolecularWeight: 319.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH2+]C(C)(C)C

InChI

InChI=1S/C17H22N2O4/c1-5-23-16(22)11-6-8-12(9-7-11)19-14(20)10-13(15(19)21)18-17(2,3)4/h6-9,13,18H,5,10H2,1-4H3/p+1/t13-/m0/s1