ethyl (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyano-propanoate

Systemtic Name: ethyl (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyano-propanoate Openeye Name: ethyl (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyano-propanoate CAS Name: (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyanopropanoate Traditional Name: (2S)-3-[(1R)-1-(1-adamantyl)ethyl]imino-2-cyano-propionic acid ethyl ester Formula: C18H26N2O2 MolecularWeight: 302.41124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O2/c1-3-22-17(21)16(10-19)11-20-12(2)18-7-13-4-14(8-18)6-15(5-13)9-18/h11-16H,3-9H2,1-2H3/t12-,13?,14?,15?,16-,18?/m1/s1