[3-[3-ethoxy-3-oxidanylidene-2-(pyridin-3-ylcarbonylamino)propyl]-1H-indol-5-yl] pyridine-3-carboxylate

Systemtic Name: [3-[3-ethoxy-3-oxidanylidene-2-(pyridin-3-ylcarbonylamino)propyl]-1H-indol-5-yl] pyridine-3-carboxylate Openeye Name: [3-[3-ethoxy-3-oxo-2-(pyridine-3-carbonylamino)propyl]-1H-indol-5-yl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [3-[3-ethoxy-3-oxo-2-[[oxo(3-pyridinyl)methyl]amino]propyl]-1H-indol-5-yl] ester IUPAC Name: [3-[3-ethoxy-3-oxo-2-(pyridine-3-carbonylamino)propyl]-1H-indol-5-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [3-(3-ethoxy-3-keto-2-nicotinamido-propyl)-1H-indol-5-yl] ester Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)OC(=O)C3=CN=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)OC(=O)C3=CN=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H22N4O5/c1-2-33-25(32)22(29-23(30)16-5-3-9-26-13-16)11-18-15-28-21-8-7-19(12-20(18)21)34-24(31)17-6-4-10-27-14-17/h3-10,12-15,22,28H,2,11H2,1H3,(H,29,30)