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

Systemtic Name: N-[(Z)-[5-bromanyl-2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]-3,4-dimethoxy-benzamide Openeye Name: N-[(Z)-[5-bromo-2-oxo-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide CAS Name: N-[(Z)-[5-bromo-2-oxo-1-(1-piperidin-1-iumylmethyl)-3-indolylidene]amino]-3,4-dimethoxybenzamide IUPAC Name: N-[(Z)-[5-bromo-2-oxo-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]-3,4-dimethoxybenzamide Traditional Name: N-[(Z)-[5-bromo-2-keto-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide Formula: C23H26BrN4O4+ MolecularWeight: 502.38094

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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+]4CCCCC4)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+]4CCCCC4)OC

InChI

InChI=1S/C23H25BrN4O4/c1-31-19-9-6-15(12-20(19)32-2)22(29)26-25-21-17-13-16(24)7-8-18(17)28(23(21)30)14-27-10-4-3-5-11-27/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(H,26,29)/p+1/b25-21-