(E)-N-(2-morpholin-4-ium-4-ylethyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(2-morpholin-4-ium-4-ylethyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(2-morpholin-4-ium-4-ylethyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(2-morpholin-4-ium-4-ylethyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(2-morpholin-4-ium-4-ylethyl)-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2/c23-18(19-8-9-21-10-12-24-13-11-21)7-6-16-14-20-22(15-16)17-4-2-1-3-5-17/h1-7,14-15H,8-13H2,(H,19,23)/p+1/b7-6+