tert-butyl 4-(5-cyanoindol-1-yl)-1,2,3,6-tetrahydropyridine-2-carboxylate

Systemtic Name: tert-butyl 4-(5-cyanoindol-1-yl)-1,2,3,6-tetrahydropyridine-2-carboxylate Openeye Name: tert-butyl 4-(5-cyanoindol-1-yl)-1,2,3,6-tetrahydropyridine-2-carboxylate CAS Name: 4-(5-cyano-1-indolyl)-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-cyanoindol-1-yl)-1,2,3,6-tetrahydropyridine-2-carboxylate Traditional Name: 4-(5-cyanoindol-1-yl)-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(=CCN1)N2C=CC3=C2C=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1CC(=CCN1)N2C=CC3=C2C=CC(=C3)C#N

InChI

InChI=1S/C19H21N3O2/c1-19(2,3)24-18(23)16-11-15(6-8-21-16)22-9-7-14-10-13(12-20)4-5-17(14)22/h4-7,9-10,16,21H,8,11H2,1-3H3