tert-butyl 9-(cyanomethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate

Systemtic Name: tert-butyl 9-(cyanomethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Openeye Name: tert-butyl 9-(cyanomethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate CAS Name: 9-(cyanomethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 9-(cyanomethyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-2-carboxylate Traditional Name: 9-(cyanomethyl)-3,4-dihydro-1H-$b-carboline-2-carboxylic acid tert-butyl ester Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1)N(C3=CC=CC=C23)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1)N(C3=CC=CC=C23)CC#N

InChI

InChI=1S/C18H21N3O2/c1-18(2,3)23-17(22)20-10-8-14-13-6-4-5-7-15(13)21(11-9-19)16(14)12-20/h4-7H,8,10-12H2,1-3H3