(3E)-3-[1-[azanyl(carbamimidoyl)amino]ethylidene]-N-phenyl-indol-1-ium-1-carboxamide

Systemtic Name: (3E)-3-[1-[azanyl(carbamimidoyl)amino]ethylidene]-N-phenyl-indol-1-ium-1-carboxamide Openeye Name: (3E)-3-[1-[amino(carbamimidoyl)amino]ethylidene]-N-phenyl-indol-1-ium-1-carboxamide CAS Name: (3E)-3-[1-[amino(carbamimidoyl)amino]ethylidene]-N-phenyl-1-indol-1-iumcarboxamide IUPAC Name: (3E)-3-[1-[amino(carbamimidoyl)amino]ethylidene]-N-phenylindol-1-ium-1-carboxamide Traditional Name: (3E)-3-[1-[amidino(amino)amino]ethylidene]-N-phenyl-indol-1-ium-1-carboxamide Formula: C18H19N6O+ MolecularWeight: 335.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=[N+](C2=CC=CC=C21)C(=O)NC3=CC=CC=C3)N(C(=N)N)N

Isomeric SMILES

C/C(=C/1\C=[N+](C2=CC=CC=C21)C(=O)NC3=CC=CC=C3)/N(C(=N)N)N

InChI

InChI=1S/C18H18N6O/c1-12(24(21)17(19)20)15-11-23(16-10-6-5-9-14(15)16)18(25)22-13-7-3-2-4-8-13/h2-11H,21H2,1H3,(H3-,19,20,22,25)/p+1