2-bromanyl-N-[(E)-[2-oxidanylidene-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide

Systemtic Name: 2-bromanyl-N-[(E)-[2-oxidanylidene-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide Openeye Name: 2-bromo-N-[(E)-[2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]benzamide CAS Name: 2-bromo-N-[(E)-[2-oxo-1-(1-pyrrolidin-1-iumylmethyl)-3-indolylidene]amino]benzamide IUPAC Name: 2-bromo-N-[(E)-[2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide Traditional Name: 2-bromo-N-[(E)-[2-keto-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]benzamide Formula: C20H20BrN4O2+ MolecularWeight: 428.3024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CN2C3=CC=CC=C3C(=NNC(=O)C4=CC=CC=C4Br)C2=O

Isomeric SMILES

C1CC[NH+](C1)CN2C3=CC=CC=C3/C(=N\NC(=O)C4=CC=CC=C4Br)/C2=O

InChI

InChI=1S/C20H19BrN4O2/c21-16-9-3-1-7-14(16)19(26)23-22-18-15-8-2-4-10-17(15)25(20(18)27)13-24-11-5-6-12-24/h1-4,7-10H,5-6,11-13H2,(H,23,26)/p+1/b22-18+