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(3-carbamimidoylphenyl)methyl 1-[(3-carbamimidoylphenyl)methylidene]indol-1-ium-2-carboxylate

(3-carbamimidoylphenyl)methyl 1-[(3-carbamimidoylphenyl)methylidene]indol-1-ium-2-carboxylate

Systemtic Name:(3-carbamimidoylphenyl)methyl 1-[(3-carbamimidoylphenyl)methylidene]indol-1-ium-2-carboxylate
Openeye Name:(3-carbamimidoylphenyl)methyl 1-[(3-carbamimidoylphenyl)methylene]indol-1-ium-2-carboxylate
CAS Name:1-[(3-carbamimidoylphenyl)methylidene]-2-indol-1-iumcarboxylic acid (3-carbamimidoylphenyl)methyl ester
IUPAC Name:(3-carbamimidoylphenyl)methyl 1-[(3-carbamimidoylphenyl)methylidene]indol-1-ium-2-carboxylate
Traditional Name:1-(3-amidinobenzylidene)indol-1-ium-2-carboxylic acid (3-amidinobenzyl) ester
Formula: C25H22N5O2+
MolecularWeight: 424.47448
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C([N+]2=CC3=CC(=CC=C3)C(=N)N)C(=O)OCC4=CC=CC(=C4)C(=N)N


Isomeric SMILES

C1=CC=C2C(=C1)C=C([N+]2=CC3=CC(=CC=C3)C(=N)N)C(=O)OCC4=CC=CC(=C4)C(=N)N


InChI

InChI=1S/C25H22N5O2/c26-23(27)19-8-3-5-16(11-19)14-30-21-10-2-1-7-18(21)13-22(30)25(31)32-15-17-6-4-9-20(12-17)24(28)29/h1-14H,15H2,(H3,26,27)(H3,28,29)/q+1


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