2-(pyridin-3-ylcarbonylamino)ethyl 2,4,5-trimethylbenzoate

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl 2,4,5-trimethylbenzoate Openeye Name: 2-(pyridine-3-carbonylamino)ethyl 2,4,5-trimethylbenzoate CAS Name: 2,4,5-trimethylbenzoic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl 2,4,5-trimethylbenzoate Traditional Name: 2,4,5-trimethylbenzoic acid 2-nicotinamidoethyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OCCNC(=O)C2=CN=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OCCNC(=O)C2=CN=CC=C2)C)C

InChI

InChI=1S/C18H20N2O3/c1-12-9-14(3)16(10-13(12)2)18(22)23-8-7-20-17(21)15-5-4-6-19-11-15/h4-6,9-11H,7-8H2,1-3H3,(H,20,21)