N-[4,4-dimethyl-8-nitro-1,3-bis(oxidanylidene)isoquinolin-7-yl]-2-methoxy-benzamide

Systemtic Name: N-[4,4-dimethyl-8-nitro-1,3-bis(oxidanylidene)isoquinolin-7-yl]-2-methoxy-benzamide Openeye Name: N-(4,4-dimethyl-8-nitro-1,3-dioxo-7-isoquinolyl)-2-methoxy-benzamide CAS Name: N-(4,4-dimethyl-8-nitro-1,3-dioxo-7-isoquinolinyl)-2-methoxybenzamide IUPAC Name: N-(4,4-dimethyl-8-nitro-1,3-dioxoisoquinolin-7-yl)-2-methoxybenzamide Traditional Name: N-(1,3-diketo-4,4-dimethyl-8-nitro-7-isoquinolyl)-2-methoxy-benzamide Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=C(C=C2)NC(=O)C3=CC=CC=C3OC)[N+](=O)[O-])C(=O)NC1=O)C

Isomeric SMILES

CC1(C2=C(C(=C(C=C2)NC(=O)C3=CC=CC=C3OC)[N+](=O)[O-])C(=O)NC1=O)C

InChI

InChI=1S/C19H17N3O6/c1-19(2)11-8-9-12(15(22(26)27)14(11)17(24)21-18(19)25)20-16(23)10-6-4-5-7-13(10)28-3/h4-9H,1-3H3,(H,20,23)(H,21,24,25)