2-azanyl-4-[(6-azanyl-1-ethyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]benzamide diiodide

Systemtic Name: 2-azanyl-4-[(6-azanyl-1-ethyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]benzamide diiodide Openeye Name: 2-amino-4-[(6-amino-1-ethyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]benzamide diiodide CAS Name: 2-amino-4-[(6-amino-1-ethyl-4-quinolin-1-iumyl)amino]-N-[4-[(1-ethyl-4-pyridin-1-iumyl)amino]phenyl]benzamide diiodide IUPAC Name: 2-amino-4-[(6-amino-1-ethylquinolin-1-ium-4-yl)amino]-N-[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]benzamide diiodide Traditional Name: 2-amino-4-[(6-amino-1-ethyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-ethylpyridin-1-ium-4-yl)amino]phenyl]benzamide diiodide Formula: C31H33I2N7O MolecularWeight: 773.44896

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)CC)N)N.[I-].[I-]

Isomeric SMILES

CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)CC)N)N.[I-].[I-]

InChI

InChI=1S/C31H31N7O.2HI/c1-3-37-16-13-24(14-17-37)34-22-6-8-23(9-7-22)36-31(39)26-11-10-25(20-28(26)33)35-29-15-18-38(4-2)30-12-5-21(32)19-27(29)30;;/h5-20H,3-4,32H2,1-2H3,(H3,33,36,39);2*1H