2-(4-nitrophenyl)carbonyl-1,3,4,10b-tetrahydropyrazino[1,2-b]isoindol-6-one

Systemtic Name: 2-(4-nitrophenyl)carbonyl-1,3,4,10b-tetrahydropyrazino[1,2-b]isoindol-6-one Openeye Name: 2-(4-nitrobenzoyl)-1,3,4,10b-tetrahydropyrazino[1,2-b]isoindol-6-one CAS Name: 2-[(4-nitrophenyl)-oxomethyl]-1,3,4,10b-tetrahydropyrazino[1,2-b]isoindol-6-one IUPAC Name: 2-(4-nitrobenzoyl)-1,3,4,10b-tetrahydropyrazino[1,2-b]isoindol-6-one Traditional Name: 2-(4-nitrobenzoyl)-1,3,4,10b-tetrahydropyrazin[1,2-b]isoindol-6-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4C2=O

Isomeric SMILES

C1CN2C(CN1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4C2=O

InChI

InChI=1S/C18H15N3O4/c22-17(12-5-7-13(8-6-12)21(24)25)19-9-10-20-16(11-19)14-3-1-2-4-15(14)18(20)23/h1-8,16H,9-11H2