N-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N'-phenyl-quinoline-2-carboximidamide

Systemtic Name: N-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-N'-phenyl-quinoline-2-carboximidamide Openeye Name: N-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-N'-phenyl-quinoline-2-carboxamidine CAS Name: N-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-N'-phenyl-2-quinolinecarboximidamide IUPAC Name: N-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-N'-phenylquinoline-2-carboximidamide Traditional Name: N-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-N'-phenyl-quinaldamidine Formula: C23H17N5O3 MolecularWeight: 411.41278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(C2=NC3=CC=CC=C3C=C2)NNC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N=C(C2=NC3=CC=CC=C3C=C2)NNC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

InChI=1S/C23H17N5O3/c29-22-13-11-19(28(30)31)14-17(22)15-24-27-23(25-18-7-2-1-3-8-18)21-12-10-16-6-4-5-9-20(16)26-21/h1-15,24H,(H,25,27)