(E)-3-(1-adamantyl)-4-piperidin-1-yl-but-2-enoic acid

Systemtic Name: (E)-3-(1-adamantyl)-4-piperidin-1-yl-but-2-enoic acid Openeye Name: (E)-3-(1-adamantyl)-4-(1-piperidyl)but-2-enoic acid CAS Name: (E)-3-(1-adamantyl)-4-(1-piperidinyl)-2-butenoic acid IUPAC Name: (E)-3-(1-adamantyl)-4-piperidin-1-ylbut-2-enoic acid Traditional Name: (E)-3-(1-adamantyl)-4-piperidino-but-2-enoic acid Formula: C19H29NO2 MolecularWeight: 303.43906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(=CC(=O)O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C1CCN(CC1)C/C(=C/C(=O)O)/C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H29NO2/c21-18(22)9-17(13-20-4-2-1-3-5-20)19-10-14-6-15(11-19)8-16(7-14)12-19/h9,14-16H,1-8,10-13H2,(H,21,22)/b17-9-