2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-(1-methylpyrrol-2-yl)-3-oxidanylidene-N-phenyl-propanamide

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-(1-methylpyrrol-2-yl)-3-oxidanylidene-N-phenyl-propanamide Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-(1-methylpyrrol-2-yl)-3-oxo-N-phenyl-propanamide CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-(1-methyl-2-pyrrolyl)-3-oxo-N-phenylpropanamide IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-(1-methylpyrrol-2-yl)-3-oxo-N-phenylpropanamide Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-cyano-3-keto-3-(1-methylpyrrol-2-yl)-N-phenyl-propionamide Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)C(C#N)C(=O)NC2=CC=CC=C2.C(CO)N(CCO)CCO

Isomeric SMILES

CN1C=CC=C1C(=O)C(C#N)C(=O)NC2=CC=CC=C2.C(CO)N(CCO)CCO

InChI

InChI=1S/C15H13N3O2.C6H15NO3/c1-18-9-5-8-13(18)14(19)12(10-16)15(20)17-11-6-3-2-4-7-11;8-4-1-7(2-5-9)3-6-10/h2-9,12H,1H3,(H,17,20);8-10H,1-6H2