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

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 3-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 3-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate CAS Name: 3-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 3-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]propanoate Traditional Name: 3-[(3aS,7aS)-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl]propionic acid [2-keto-2-(propylamino)ethyl] ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)CCN1C(=O)C2CC=CCC2C1=O

Isomeric SMILES

CCCNC(=O)COC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O

InChI

InChI=1S/C16H22N2O5/c1-2-8-17-13(19)10-23-14(20)7-9-18-15(21)11-5-3-4-6-12(11)16(18)22/h3-4,11-12H,2,5-10H2,1H3,(H,17,19)/t11-,12-/m0/s1