propan-2-yl (2R)-3-(1-adamantyl)-2-cyano-3-oxidanylidene-propanoate

Systemtic Name: propan-2-yl (2R)-3-(1-adamantyl)-2-cyano-3-oxidanylidene-propanoate Openeye Name: isopropyl (2R)-3-(1-adamantyl)-2-cyano-3-oxo-propanoate CAS Name: (2R)-3-(1-adamantyl)-2-cyano-3-oxopropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2R)-3-(1-adamantyl)-2-cyano-3-oxopropanoate Traditional Name: (2R)-3-(1-adamantyl)-2-cyano-3-keto-propionic acid isopropyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C#N)C(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)OC(=O)[C@H](C#N)C(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C17H23NO3/c1-10(2)21-16(20)14(9-18)15(19)17-6-11-3-12(7-17)5-13(4-11)8-17/h10-14H,3-8H2,1-2H3/t11?,12?,13?,14-,17?/m1/s1