N-(4-acetamidophenyl)-3-[2-(3-azanyl-5-nitro-phenyl)carbonylhydrazinyl]but-3-enamide

Systemtic Name: N-(4-acetamidophenyl)-3-[2-(3-azanyl-5-nitro-phenyl)carbonylhydrazinyl]but-3-enamide Openeye Name: N-(4-acetamidophenyl)-3-[2-(3-amino-5-nitro-benzoyl)hydrazino]but-3-enamide CAS Name: N-(4-acetamidophenyl)-3-[[(3-amino-5-nitrophenyl)-oxomethyl]hydrazo]-3-butenamide IUPAC Name: N-(4-acetamidophenyl)-3-[2-(3-amino-5-nitrobenzoyl)hydrazinyl]but-3-enamide Traditional Name: N-(4-acetamidophenyl)-3-[N'-(3-amino-5-nitro-benzoyl)hydrazino]but-3-enamide Formula: C19H20N6O5 MolecularWeight: 412.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CC(=C)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CC(=C)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])N

InChI

InChI=1S/C19H20N6O5/c1-11(7-18(27)22-16-5-3-15(4-6-16)21-12(2)26)23-24-19(28)13-8-14(20)10-17(9-13)25(29)30/h3-6,8-10,23H,1,7,20H2,2H3,(H,21,26)(H,22,27)(H,24,28)