[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[(3aR,7aR)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate

Systemtic Name: [2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[(3aR,7aR)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate Openeye Name: [2-(cyclohexylcarbamoylamino)-2-oxo-ethyl] 3-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate CAS Name: 3-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoic acid [2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 3-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate Traditional Name: 3-[(3aR,7aR)-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl]propionic acid [2-(cyclohexylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H27N3O6 MolecularWeight: 405.44488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)COC(=O)CCN2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)COC(=O)CCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O

InChI

InChI=1S/C20H27N3O6/c24-16(22-20(28)21-13-6-2-1-3-7-13)12-29-17(25)10-11-23-18(26)14-8-4-5-9-15(14)19(23)27/h4-5,13-15H,1-3,6-12H2,(H2,21,22,24,28)/t14-,15-/m1/s1