[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid phthalimidomethyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C23H27N3O5/c27-19(31-13-26-20(28)17-3-1-2-4-18(17)21(26)29)5-6-24-22(30)25-23-10-14-7-15(11-23)9-16(8-14)12-23/h1-4,14-16H,5-13H2,(H2,24,25,30)