(4Z)-4-(dimethylaminomethylidene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-(dimethylaminomethylidene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione Openeye Name: (4Z)-4-(dimethylaminomethylene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-dione CAS Name: (4Z)-4-(dimethylaminomethylidene)-2-(4-ethoxy-2-nitrophenyl)isoquinoline-1,3-dione IUPAC Name: (4Z)-4-(dimethylaminomethylidene)-2-(4-ethoxy-2-nitrophenyl)isoquinoline-1,3-dione Traditional Name: (4Z)-4-(dimethylaminomethylene)-2-(4-ethoxy-2-nitro-phenyl)isoquinoline-1,3-quinone Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CN(C)C)C2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3/C(=C/N(C)C)/C2=O)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5/c1-4-28-13-9-10-17(18(11-13)23(26)27)22-19(24)15-8-6-5-7-14(15)16(20(22)25)12-21(2)3/h5-12H,4H2,1-3H3/b16-12-