[(5S)-5-(4-methylpiperidin-1-ium-1-yl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-morpholin-4-yl-methanone

Systemtic Name: [(5S)-5-(4-methylpiperidin-1-ium-1-yl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-morpholin-4-yl-methanone Openeye Name: [(5S)-1-allyl-5-(4-methylpiperidin-1-ium-1-yl)-4,5,6,7-tetrahydroindazol-3-yl]-morpholino-methanone CAS Name: [(5S)-5-(4-methyl-1-piperidin-1-iumyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-(4-morpholinyl)methanone IUPAC Name: [(5S)-5-(4-methylpiperidin-1-ium-1-yl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-3-yl]-morpholin-4-ylmethanone Traditional Name: [(5S)-1-allyl-5-(4-methylpiperidin-1-ium-1-yl)-4,5,6,7-tetrahydroindazol-3-yl]-morpholino-methanone Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2CCC3=C(C2)C(=NN3CC=C)C(=O)N4CCOCC4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H]2CCC3=C(C2)C(=NN3CC=C)C(=O)N4CCOCC4

InChI

InChI=1S/C21H32N4O2/c1-3-8-25-19-5-4-17(23-9-6-16(2)7-10-23)15-18(19)20(22-25)21(26)24-11-13-27-14-12-24/h3,16-17H,1,4-15H2,2H3/p+1/t17-/m0/s1