tert-butyl 3-[2-(2-cyano-3-methyl-piperidin-1-yl)ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[2-(2-cyano-3-methyl-piperidin-1-yl)ethyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[2-(2-cyano-3-methyl-1-piperidyl)ethyl]indole-1-carboxylate CAS Name: 3-[2-(2-cyano-3-methyl-1-piperidinyl)ethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(2-cyano-3-methylpiperidin-1-yl)ethyl]indole-1-carboxylate Traditional Name: 3-[2-(2-cyano-3-methyl-piperidino)ethyl]indole-1-carboxylic acid tert-butyl ester Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1C#N)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CCCN(C1C#N)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H29N3O2/c1-16-8-7-12-24(20(16)14-23)13-11-17-15-25(21(26)27-22(2,3)4)19-10-6-5-9-18(17)19/h5-6,9-10,15-16,20H,7-8,11-13H2,1-4H3