4-[3-(4-ethylpiperazin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid

Systemtic Name: 4-[3-(4-ethylpiperazin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid Openeye Name: 4-[3-(4-ethylpiperazin-1-yl)-2,5-dioxo-pyrrolidin-1-yl]benzoic acid CAS Name: 4-[3-(4-ethyl-1-piperazinyl)-2,5-dioxo-1-pyrrolidinyl]benzoic acid IUPAC Name: 4-[3-(4-ethylpiperazin-1-yl)-2,5-dioxopyrrolidin-1-yl]benzoic acid Traditional Name: 4-[3-(4-ethylpiperazino)-2,5-diketo-pyrrolidino]benzoic acid Formula: C17H21N3O4 MolecularWeight: 331.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H21N3O4/c1-2-18-7-9-19(10-8-18)14-11-15(21)20(16(14)22)13-5-3-12(4-6-13)17(23)24/h3-6,14H,2,7-11H2,1H3,(H,23,24)