tert-butyl 6-aminocarbonyl-2-(piperidin-4-ylmethyl)quinoline-3-carboxylate

Systemtic Name: tert-butyl 6-aminocarbonyl-2-(piperidin-4-ylmethyl)quinoline-3-carboxylate Openeye Name: tert-butyl 6-carbamoyl-2-(4-piperidylmethyl)quinoline-3-carboxylate CAS Name: 6-carbamoyl-2-(4-piperidinylmethyl)-3-quinolinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-carbamoyl-2-(piperidin-4-ylmethyl)quinoline-3-carboxylate Traditional Name: 6-carbamoyl-2-(4-piperidylmethyl)quinoline-3-carboxylic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(N=C2C=CC(=CC2=C1)C(=O)N)CC3CCNCC3

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(N=C2C=CC(=CC2=C1)C(=O)N)CC3CCNCC3

InChI

InChI=1S/C21H27N3O3/c1-21(2,3)27-20(26)16-12-15-11-14(19(22)25)4-5-17(15)24-18(16)10-13-6-8-23-9-7-13/h4-5,11-13,23H,6-10H2,1-3H3,(H2,22,25)