methyl 5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-yl-propoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-yl-propoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[(2S)-2-(tert-butoxycarbonylamino)-3-(4-pyridyl)propoxy]pyridine-3-carboxylate CAS Name: 5-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridin-4-ylpropoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-ylpropoxy]pyridine-3-carboxylate Traditional Name: 5-[(2S)-2-(tert-butoxycarbonylamino)-3-(4-pyridyl)propoxy]nicotinic acid methyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=NC=C1)COC2=CN=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=NC=C1)COC2=CN=CC(=C2)C(=O)OC

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)28-19(25)23-16(9-14-5-7-21-8-6-14)13-27-17-10-15(11-22-12-17)18(24)26-4/h5-8,10-12,16H,9,13H2,1-4H3,(H,23,25)/t16-/m0/s1