N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]benzamide

Systemtic Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]benzamide Openeye Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxo-indolin-3-ylidene]amino]benzamide CAS Name: N-[(E)-[1-[(4-methyl-1-piperazin-4-iumyl)methyl]-2-oxo-3-indolylidene]amino]benzamide IUPAC Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxoindol-3-ylidene]amino]benzamide Traditional Name: N-[(E)-[2-keto-1-[(4-methylpiperazin-4-ium-1-yl)methyl]indolin-3-ylidene]amino]benzamide Formula: C21H24N5O2+ MolecularWeight: 378.44756

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3C(=NNC(=O)C4=CC=CC=C4)C2=O

Isomeric SMILES

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3/C(=N\NC(=O)C4=CC=CC=C4)/C2=O

InChI

InChI=1S/C21H23N5O2/c1-24-11-13-25(14-12-24)15-26-18-10-6-5-9-17(18)19(21(26)28)22-23-20(27)16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H,23,27)/p+1/b22-19+