N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide

Systemtic Name: N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide Openeye Name: N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide CAS Name: N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxypropanamide IUPAC Name: N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxypropanamide Traditional Name: N-[2-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propionamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)NC1=CC2=C(CC[NH+](C2)CC3=C(NN=C3)C4CCCCC4)C=C1

Isomeric SMILES

COCCC(=O)NC1=CC2=C(CC[NH+](C2)CC3=C(NN=C3)C4CCCCC4)C=C1

InChI

InChI=1S/C23H32N4O2/c1-29-12-10-22(28)25-21-8-7-17-9-11-27(15-19(17)13-21)16-20-14-24-26-23(20)18-5-3-2-4-6-18/h7-8,13-14,18H,2-6,9-12,15-16H2,1H3,(H,24,26)(H,25,28)/p+1