ethyl (E)-4-(2-adamantylidene)-2-cyano-but-2-enoate

Systemtic Name: ethyl (E)-4-(2-adamantylidene)-2-cyano-but-2-enoate Openeye Name: ethyl (E)-4-(2-adamantylidene)-2-cyano-but-2-enoate CAS Name: (E)-4-(2-adamantylidene)-2-cyano-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(2-adamantylidene)-2-cyanobut-2-enoate Traditional Name: (E)-4-(2-adamantylidene)-2-cyano-but-2-enoic acid ethyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C1C2CC3CC(C2)CC1C3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C=C1C2CC3CC(C2)CC1C3)/C#N

InChI

InChI=1S/C17H21NO2/c1-2-20-17(19)13(10-18)3-4-16-14-6-11-5-12(8-14)9-15(16)7-11/h3-4,11-12,14-15H,2,5-9H2,1H3/b13-3+,16-4?