ethyl 2-butyl-4-(phenylcarbonyl)-3-[2-(phenylmethoxycarbonylamino)ethanoylamino]-2H-pyridine-1-carboxylate

Systemtic Name: ethyl 2-butyl-4-(phenylcarbonyl)-3-[2-(phenylmethoxycarbonylamino)ethanoylamino]-2H-pyridine-1-carboxylate Openeye Name: ethyl 4-benzoyl-3-[[2-(benzyloxycarbonylamino)acetyl]amino]-2-butyl-2H-pyridine-1-carboxylate CAS Name: 4-benzoyl-2-butyl-3-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]-2H-pyridine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-2-butyl-3-[[2-(phenylmethoxycarbonylamino)acetyl]amino]-2H-pyridine-1-carboxylate Traditional Name: 4-benzoyl-3-[[2-(benzyloxycarbonylamino)acetyl]amino]-2-butyl-2H-pyridine-1-carboxylic acid ethyl ester Formula: C29H33N3O6 MolecularWeight: 519.58882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=C(C=CN1C(=O)OCC)C(=O)C2=CC=CC=C2)NC(=O)CNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC1C(=C(C=CN1C(=O)OCC)C(=O)C2=CC=CC=C2)NC(=O)CNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H33N3O6/c1-3-5-16-24-26(31-25(33)19-30-28(35)38-20-21-12-8-6-9-13-21)23(17-18-32(24)29(36)37-4-2)27(34)22-14-10-7-11-15-22/h6-15,17-18,24H,3-5,16,19-20H2,1-2H3,(H,30,35)(H,31,33)