tert-butyl 3-[2-(2-cyano-5-methyl-piperidin-1-yl)ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[2-(2-cyano-5-methyl-piperidin-1-yl)ethyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[2-(2-cyano-5-methyl-1-piperidyl)ethyl]indole-1-carboxylate CAS Name: 3-[2-(2-cyano-5-methyl-1-piperidinyl)ethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(2-cyano-5-methylpiperidin-1-yl)ethyl]indole-1-carboxylate Traditional Name: 3-[2-(2-cyano-5-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:

CC1CCC(N(C1)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CC1CCC(N(C1)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)C#N

InChI

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