methyl 6-chloranyl-3-methoxy-5-[(phenylmethyl)amino]pyrazine-2-carboxylate

Systemtic Name: methyl 6-chloranyl-3-methoxy-5-[(phenylmethyl)amino]pyrazine-2-carboxylate Openeye Name: methyl 5-(benzylamino)-6-chloro-3-methoxy-pyrazine-2-carboxylate CAS Name: 6-chloro-3-methoxy-5-[(phenylmethyl)amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 5-(benzylamino)-6-chloro-3-methoxypyrazine-2-carboxylate Traditional Name: 5-(benzylamino)-6-chloro-3-methoxy-pyrazinic acid methyl ester Formula: C14H14ClN3O3 MolecularWeight: 307.73226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(C(=N1)NCC2=CC=CC=C2)Cl)C(=O)OC

Isomeric SMILES

COC1=C(N=C(C(=N1)NCC2=CC=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C14H14ClN3O3/c1-20-13-10(14(19)21-2)17-11(15)12(18-13)16-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,16,18)