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

Systemtic Name: 2-(2-methylphenoxy)-N-[(E)-[2-oxidanylidene-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]ethanamide Openeye Name: 2-(2-methylphenoxy)-N-[(E)-[2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]acetamide CAS Name: 2-(2-methylphenoxy)-N-[(E)-[2-oxo-1-(1-pyrrolidin-1-iumylmethyl)-3-indolylidene]amino]acetamide IUPAC Name: 2-(2-methylphenoxy)-N-[(E)-[2-oxo-1-(pyrrolidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]acetamide Traditional Name: N-[(E)-[2-keto-1-(pyrrolidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]-2-(2-methylphenoxy)acetamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NN=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCCC4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)N/N=C/2\C3=CC=CC=C3N(C2=O)C[NH+]4CCCC4

InChI

InChI=1S/C22H24N4O3/c1-16-8-2-5-11-19(16)29-14-20(27)23-24-21-17-9-3-4-10-18(17)26(22(21)28)15-25-12-6-7-13-25/h2-5,8-11H,6-7,12-15H2,1H3,(H,23,27)/p+1/b24-21+