[(3S)-1-(4-methoxycarbonylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-phenethyl-azanium

Systemtic Name: [(3S)-1-(4-methoxycarbonylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-phenethyl-azanium Openeye Name: [(3S)-1-(4-methoxycarbonylphenyl)-2,5-dioxo-pyrrolidin-3-yl]-phenethyl-ammonium CAS Name: [(3S)-1-(4-methoxycarbonylphenyl)-2,5-dioxo-3-pyrrolidinyl]-phenethylammonium IUPAC Name: [(3S)-1-(4-methoxycarbonylphenyl)-2,5-dioxopyrrolidin-3-yl]-phenethylazanium Traditional Name: [(3S)-1-(4-carbomethoxyphenyl)-2,5-diketo-pyrrolidin-3-yl]-phenethyl-ammonium Formula: C20H21N2O4+ MolecularWeight: 353.39174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-26-20(25)15-7-9-16(10-8-15)22-18(23)13-17(19(22)24)21-12-11-14-5-3-2-4-6-14/h2-10,17,21H,11-13H2,1H3/p+1/t17-/m0/s1