(3Z)-3-[(4-phenylpiperazin-1-ium-1-yl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: (3Z)-3-[(4-phenylpiperazin-1-ium-1-yl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Openeye Name: (3Z)-3-[(4-phenylpiperazin-1-ium-1-yl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one CAS Name: (3Z)-3-[(4-phenyl-1-piperazin-1-iumyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one IUPAC Name: (3Z)-3-[(4-phenylpiperazin-1-ium-1-yl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Traditional Name: (3Z)-3-[(4-phenylpiperazin-1-ium-1-yl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Formula: C22H23N4O+ MolecularWeight: 359.44422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=NC3=CC=CC=C3C2=O)C1=C[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C\1CN2C(=NC3=CC=CC=C3C2=O)/C1=C\[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C22H22N4O/c27-22-19-8-4-5-9-20(19)23-21-17(10-11-26(21)22)16-24-12-14-25(15-13-24)18-6-2-1-3-7-18/h1-9,16H,10-15H2/p+1/b17-16-