3-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(phenylmethyl)propanamide

Systemtic Name: 3-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-(5-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)propanamide CAS Name: 3-(5-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propanamide Traditional Name: N-benzyl-3-(1,3-diketo-5-nitro-benzo[de]isoquinolin-2-yl)propionamide Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5/c26-19(23-13-14-5-2-1-3-6-14)9-10-24-21(27)17-8-4-7-15-11-16(25(29)30)12-18(20(15)17)22(24)28/h1-8,11-12H,9-10,13H2,(H,23,26)