pyridin-2-ylmethyl 8-[2-aminocarbonyl-6-(quinolin-2-ylcarbonylamino)phenyl]octanoate

Systemtic Name: pyridin-2-ylmethyl 8-[2-aminocarbonyl-6-(quinolin-2-ylcarbonylamino)phenyl]octanoate Openeye Name: 2-pyridylmethyl 8-[2-carbamoyl-6-(quinoline-2-carbonylamino)phenyl]octanoate CAS Name: 8-[2-carbamoyl-6-[[oxo(2-quinolinyl)methyl]amino]phenyl]octanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 8-[2-carbamoyl-6-(quinoline-2-carbonylamino)phenyl]octanoate Traditional Name: 8-[2-carbamoyl-6-(quinaldoylamino)phenyl]caprylic acid 2-pyridylmethyl ester Formula: C31H32N4O4 MolecularWeight: 524.61018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=CC=CC(=C3CCCCCCCC(=O)OCC4=CC=CC=N4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=CC=CC(=C3CCCCCCCC(=O)OCC4=CC=CC=N4)C(=O)N

InChI

InChI=1S/C31H32N4O4/c32-30(37)25-14-10-16-27(35-31(38)28-19-18-22-11-6-7-15-26(22)34-28)24(25)13-4-2-1-3-5-17-29(36)39-21-23-12-8-9-20-33-23/h6-12,14-16,18-20H,1-5,13,17,21H2,(H2,32,37)(H,35,38)