1-oxidanylidene-2-(phenylmethyl)-3,4,6,10b-tetrahydropyrazino[1,2-b]isoindole-6-carboxylic acid

Systemtic Name: 1-oxidanylidene-2-(phenylmethyl)-3,4,6,10b-tetrahydropyrazino[1,2-b]isoindole-6-carboxylic acid Openeye Name: 2-benzyl-1-oxo-3,4,6,10b-tetrahydropyrazino[1,2-b]isoindole-6-carboxylic acid CAS Name: 1-oxo-2-(phenylmethyl)-3,4,6,10b-tetrahydropyrazino[1,2-b]isoindole-6-carboxylic acid IUPAC Name: 2-benzyl-1-oxo-3,4,6,10b-tetrahydropyrazino[1,2-b]isoindole-6-carboxylic acid Traditional Name: 2-benzyl-1-keto-3,4,6,10b-tetrahydropyrazin[1,2-b]isoindole-6-carboxylic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(C3=CC=CC=C3C2C(=O)O)C(=O)N1CC4=CC=CC=C4

Isomeric SMILES

C1CN2C(C3=CC=CC=C3C2C(=O)O)C(=O)N1CC4=CC=CC=C4

InChI

InChI=1S/C19H18N2O3/c22-18-16-14-8-4-5-9-15(14)17(19(23)24)21(16)11-10-20(18)12-13-6-2-1-3-7-13/h1-9,16-17H,10-12H2,(H,23,24)