[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C14H15N5O3/c1-11-8-18-12(9-17-11)14(21)22-10-13(20)19(6-2-4-15)7-3-5-16/h8-9H,2-3,6-7,10H2,1H3