N-[2-[(2-cyclopentyloxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide

Systemtic Name: N-[2-[(2-cyclopentyloxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide Openeye Name: N-[2-[[2-(cyclopentoxy)phenyl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propanamide CAS Name: N-[2-[(2-cyclopentyloxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxypropanamide IUPAC Name: N-[2-[(2-cyclopentyloxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxypropanamide Traditional Name: N-[2-[2-(cyclopentoxy)benzyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-3-methoxy-propionamide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)NC1=CC2=C(CC[NH+](C2)CC3=CC=CC=C3OC4CCCC4)C=C1

Isomeric SMILES

COCCC(=O)NC1=CC2=C(CC[NH+](C2)CC3=CC=CC=C3OC4CCCC4)C=C1

InChI

InChI=1S/C25H32N2O3/c1-29-15-13-25(28)26-22-11-10-19-12-14-27(18-21(19)16-22)17-20-6-2-5-9-24(20)30-23-7-3-4-8-23/h2,5-6,9-11,16,23H,3-4,7-8,12-15,17-18H2,1H3,(H,26,28)/p+1