propan-2-yl 4-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]ethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-keto-2-pyrrolidino-ethyl)piperazino]acetyl]amino]benzoic acid isopropyl ester Formula: C22H32N4O4 MolecularWeight: 416.51388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C22H32N4O4/c1-17(2)30-22(29)18-5-7-19(8-6-18)23-20(27)15-24-11-13-25(14-12-24)16-21(28)26-9-3-4-10-26/h5-8,17H,3-4,9-16H2,1-2H3,(H,23,27)