[2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxidanylidene-ethyl] 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxidanylidene-ethyl] 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: [2-[[(1S)-1,5-dimethylhexyl]amino]-2-oxo-ethyl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxoethyl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid [2-[[(1S)-1,5-dimethylhexyl]amino]-2-keto-ethyl] ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)C1=CC=C(C=C1)CN2CCCC2=O

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)COC(=O)C1=CC=C(C=C1)CN2CCCC2=O

InChI

InChI=1S/C22H32N2O4/c1-16(2)6-4-7-17(3)23-20(25)15-28-22(27)19-11-9-18(10-12-19)14-24-13-5-8-21(24)26/h9-12,16-17H,4-8,13-15H2,1-3H3,(H,23,25)/t17-/m0/s1