N-[(E)-[5-bromanyl-2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]furan-2-carboxamide

Systemtic Name: N-[(E)-[5-bromanyl-2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]furan-2-carboxamide Openeye Name: N-[(E)-[5-bromo-2-oxo-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]furan-2-carboxamide CAS Name: N-[(E)-[5-bromo-2-oxo-1-(1-piperidin-1-iumylmethyl)-3-indolylidene]amino]-2-furancarboxamide IUPAC Name: N-[(E)-[5-bromo-2-oxo-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]furan-2-carboxamide Traditional Name: N-[(E)-[5-bromo-2-keto-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-2-furamide Formula: C19H20BrN4O3+ MolecularWeight: 432.2911

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C3=C(C=C(C=C3)Br)C(=NNC(=O)C4=CC=CO4)C2=O

Isomeric SMILES

C1CC[NH+](CC1)CN2C3=C(C=C(C=C3)Br)/C(=N\NC(=O)C4=CC=CO4)/C2=O

InChI

InChI=1S/C19H19BrN4O3/c20-13-6-7-15-14(11-13)17(21-22-18(25)16-5-4-10-27-16)19(26)24(15)12-23-8-2-1-3-9-23/h4-7,10-11H,1-3,8-9,12H2,(H,22,25)/p+1/b21-17+