(phenylmethyl) 9-chloranyl-5-oxidanylidene-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylate

Systemtic Name: (phenylmethyl) 9-chloranyl-5-oxidanylidene-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylate Openeye Name: benzyl 9-chloro-5-oxo-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylate CAS Name: 9-chloro-5-oxo-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-chloro-5-oxo-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylate Traditional Name: 9-chloro-5-keto-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-3-carboxylic acid benzyl ester Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN1C(=O)OCC3=CC=CC=C3)C(=O)NC4=C2C=C(C=C4)Cl

Isomeric SMILES

C1CN2C(CN1C(=O)OCC3=CC=CC=C3)C(=O)NC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C19H18ClN3O3/c20-14-6-7-15-16(10-14)23-9-8-22(11-17(23)18(24)21-15)19(25)26-12-13-4-2-1-3-5-13/h1-7,10,17H,8-9,11-12H2,(H,21,24)