ethyl 1-[3-[(phenylmethyl)-pyrazin-2-ylcarbonyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(phenylmethyl)-pyrazin-2-ylcarbonyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[benzyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-[[oxo(2-pyrazinyl)methyl]-(phenylmethyl)amino]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[benzyl(pyrazine-2-carbonyl)amino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[benzyl(pyrazinoyl)amino]propanoyl]isonipecotic acid ethyl ester Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C23H28N4O4/c1-2-31-23(30)19-8-13-26(14-9-19)21(28)10-15-27(17-18-6-4-3-5-7-18)22(29)20-16-24-11-12-25-20/h3-7,11-12,16,19H,2,8-10,13-15,17H2,1H3