tert-butyl 4-[(E)-2-(2,6-dimethyl-4-pyrrolidin-1-yl-phenyl)ethenyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-2-(2,6-dimethyl-4-pyrrolidin-1-yl-phenyl)ethenyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-2-(2,6-dimethyl-4-pyrrolidin-1-yl-phenyl)vinyl]piperidine-1-carboxylate CAS Name: 4-[(E)-2-[2,6-dimethyl-4-(1-pyrrolidinyl)phenyl]ethenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-2-(2,6-dimethyl-4-pyrrolidin-1-ylphenyl)ethenyl]piperidine-1-carboxylate Traditional Name: 4-[(E)-2-(2,6-dimethyl-4-pyrrolidino-phenyl)vinyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H36N2O2 MolecularWeight: 384.55484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C=CC2CCN(CC2)C(=O)OC(C)(C)C)C)N3CCCC3

Isomeric SMILES

CC1=CC(=CC(=C1/C=C/C2CCN(CC2)C(=O)OC(C)(C)C)C)N3CCCC3

InChI

InChI=1S/C24H36N2O2/c1-18-16-21(25-12-6-7-13-25)17-19(2)22(18)9-8-20-10-14-26(15-11-20)23(27)28-24(3,4)5/h8-9,16-17,20H,6-7,10-15H2,1-5H3/b9-8+