[2-azanyl-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl] piperidine-1-carboxylate

Systemtic Name: [2-azanyl-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl] piperidine-1-carboxylate Openeye Name: [2-amino-6-(2-benzyloxyphenyl)-3-cyano-4-pyridyl] piperidine-1-carboxylate CAS Name: 1-piperidinecarboxylic acid [2-amino-3-cyano-6-(2-phenylmethoxyphenyl)-4-pyridinyl] ester IUPAC Name: [2-amino-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl] piperidine-1-carboxylate Traditional Name: piperidine-1-carboxylic acid [2-amino-6-(2-benzoxyphenyl)-3-cyano-4-pyridyl] ester Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)OC2=CC(=NC(=C2C#N)N)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)OC2=CC(=NC(=C2C#N)N)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O3/c26-16-20-23(32-25(30)29-13-7-2-8-14-29)15-21(28-24(20)27)19-11-5-6-12-22(19)31-17-18-9-3-1-4-10-18/h1,3-6,9-12,15H,2,7-8,13-14,17H2,(H2,27,28)