N-[(E)-[5-bromanyl-2-oxidanylidene-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(E)-[5-bromanyl-2-oxidanylidene-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]-3,4-dimethoxy-benzamide Openeye Name: N-[(E)-[5-bromo-2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide CAS Name: N-[(E)-[5-bromo-2-oxo-1-(1-pyrrolidin-1-iumylmethyl)-3-indolylidene]amino]-3,4-dimethoxybenzamide IUPAC Name: N-[(E)-[5-bromo-2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]-3,4-dimethoxybenzamide Traditional Name: N-[(E)-[5-bromo-2-keto-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide Formula: C22H24BrN4O4+ MolecularWeight: 488.35436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)C[NH+]4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N/N=C/2\C3=C(C=CC(=C3)Br)N(C2=O)C[NH+]4CCCC4)OC

InChI

InChI=1S/C22H23BrN4O4/c1-30-18-8-5-14(11-19(18)31-2)21(28)25-24-20-16-12-15(23)6-7-17(16)27(22(20)29)13-26-9-3-4-10-26/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,25,28)/p+1/b24-20+