methyl 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoyl]pyridin-2-yl]pyridine-4-carboxylate

Systemtic Name: methyl 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoyl]pyridin-2-yl]pyridine-4-carboxylate Openeye Name: methyl 2-[4-[3-(tert-butoxycarbonylamino)propylcarbamoyl]-2-pyridyl]pyridine-4-carboxylate CAS Name: 2-[4-[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]-oxomethyl]-2-pyridinyl]-4-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoyl]pyridin-2-yl]pyridine-4-carboxylate Traditional Name: 2-[4-[3-(tert-butoxycarbonylamino)propylcarbamoyl]-2-pyridyl]isonicotinic acid methyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCNC(=O)C1=CC(=NC=C1)C2=NC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCNC(=O)C1=CC(=NC=C1)C2=NC=CC(=C2)C(=O)OC

InChI

InChI=1S/C21H26N4O5/c1-21(2,3)30-20(28)25-9-5-8-24-18(26)14-6-10-22-16(12-14)17-13-15(7-11-23-17)19(27)29-4/h6-7,10-13H,5,8-9H2,1-4H3,(H,24,26)(H,25,28)