N,1-bis(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-5-oxidanylidene-2H-1,2,3-triazol-3-ium-4-carboxamide

Systemtic Name: N,1-bis(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-5-oxidanylidene-2H-1,2,3-triazol-3-ium-4-carboxamide Openeye Name: 3-(2-morpholinoethyl)-5-oxo-N,1-bis(p-tolyl)-2H-triazol-3-ium-4-carboxamide CAS Name: N,1-bis(4-methylphenyl)-3-[2-(4-morpholinyl)ethyl]-5-oxo-2H-triazol-3-ium-4-carboxamide IUPAC Name: N,1-bis(4-methylphenyl)-3-(2-morpholin-4-ylethyl)-5-oxo-2H-triazol-3-ium-4-carboxamide Traditional Name: 5-keto-3-(2-morpholinoethyl)-N,1-bis(p-tolyl)-2H-triazol-3-ium-4-carboxamide Formula: C23H28N5O3+ MolecularWeight: 422.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC=C(C=C3)C)CCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=[N+](NN(C2=O)C3=CC=C(C=C3)C)CCN4CCOCC4

InChI

InChI=1S/C23H27N5O3/c1-17-3-7-19(8-4-17)24-22(29)21-23(30)28(20-9-5-18(2)6-10-20)25-27(21)12-11-26-13-15-31-16-14-26/h3-10H,11-16H2,1-2H3,(H-,24,25,29,30)/p+1