2-[(3-nitrophenyl)methyl]-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxamide

Systemtic Name: 2-[(3-nitrophenyl)methyl]-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxamide Openeye Name: 2-[(3-nitrophenyl)methyl]-1,3-dioxo-4H-isoquinoline-4-carboxamide CAS Name: 2-[(3-nitrophenyl)methyl]-1,3-dioxo-4H-isoquinoline-4-carboxamide IUPAC Name: 2-[(3-nitrophenyl)methyl]-1,3-dioxo-4H-isoquinoline-4-carboxamide Traditional Name: 1,3-diketo-2-(3-nitrobenzyl)-4H-isoquinoline-4-carboxamide Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C17H13N3O5/c18-15(21)14-12-6-1-2-7-13(12)16(22)19(17(14)23)9-10-4-3-5-11(8-10)20(24)25/h1-8,14H,9H2,(H2,18,21)