4-methoxy-N-[[2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide

Systemtic Name: 4-methoxy-N-[[2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide Openeye Name: 4-methoxy-N-[[2-oxo-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]benzamide CAS Name: 4-methoxy-N-[[2-oxo-1-(1-piperidin-1-iumylmethyl)-3-indolylidene]amino]benzamide IUPAC Name: 4-methoxy-N-[[2-oxo-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]benzamide Traditional Name: N-[[2-keto-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-4-methoxy-benzamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NN=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NN=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCCCC4

InChI

InChI=1S/C22H24N4O3/c1-29-17-11-9-16(10-12-17)21(27)24-23-20-18-7-3-4-8-19(18)26(22(20)28)15-25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,24,27)/p+1