N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazole-3-carboxamide CAS Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-3-isoxazolecarboxamide IUPAC Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazole-3-carboxamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)CN(C)C(=O)C2=NOC(=C2)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=NN1)CN(C)C(=O)C2=NOC(=C2)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H23N5O2/c1-14-9-17(22-21-14)12-24(2)20(26)19-10-18(27-23-19)13-25-8-7-15-5-3-4-6-16(15)11-25/h3-6,9-10H,7-8,11-13H2,1-2H3,(H,21,22)/p+1