methyl 3-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazine-2-carboxylate

Systemtic Name: methyl 3-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazine-2-carboxylate Openeye Name: methyl 3-[2-[(tert-butoxycarbonylamino)methyl]phenyl]pyrazine-2-carboxylate CAS Name: 3-[2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazine-2-carboxylate Traditional Name: 3-[2-[(tert-butoxycarbonylamino)methyl]phenyl]pyrazinic acid methyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC=C1C2=NC=CN=C2C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC=C1C2=NC=CN=C2C(=O)OC

InChI

InChI=1S/C18H21N3O4/c1-18(2,3)25-17(23)21-11-12-7-5-6-8-13(12)14-15(16(22)24-4)20-10-9-19-14/h5-10H,11H2,1-4H3,(H,21,23)