[2-[[(4S)-4-methyl-2,5-bis(oxidanylidene)-4-phenethyl-imidazolidin-1-yl]amino]-2-oxidanylidene-ethyl] 4-methylbenzoate

Systemtic Name: [2-[[(4S)-4-methyl-2,5-bis(oxidanylidene)-4-phenethyl-imidazolidin-1-yl]amino]-2-oxidanylidene-ethyl] 4-methylbenzoate Openeye Name: [2-[[(4S)-4-methyl-2,5-dioxo-4-phenethyl-imidazolidin-1-yl]amino]-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[[(4S)-4-methyl-2,5-dioxo-4-phenethyl-1-imidazolidinyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(4S)-4-methyl-2,5-dioxo-4-phenethylimidazolidin-1-yl]amino]-2-oxoethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[[(4S)-2,5-diketo-4-methyl-4-phenethyl-imidazolidin-1-yl]amino]-2-keto-ethyl] ester Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)NN2C(=O)C(NC2=O)(C)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)NN2C(=O)[C@](NC2=O)(C)CCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5/c1-15-8-10-17(11-9-15)19(27)30-14-18(26)24-25-20(28)22(2,23-21(25)29)13-12-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,23,29)(H,24,26)/t22-/m0/s1