[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=NC=CN=C3N

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C16H16N4O4/c17-15-14(18-6-7-19-15)16(22)24-9-13(21)20-11-5-8-23-12-4-2-1-3-10(11)12/h1-4,6-7,11H,5,8-9H2,(H2,17,19)(H,20,21)