N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]ethanamide

Systemtic Name: N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]ethanamide Openeye Name: N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]acetamide CAS Name: N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]acetamide IUPAC Name: N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]acetamide Traditional Name: N-(3-chlorophenyl)-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]acetamide Formula: C17H18ClN2O+ MolecularWeight: 301.79062

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[NH2+][C@H](C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H17ClN2O/c18-13-5-3-6-14(10-13)20-17(21)11-16-15-7-2-1-4-12(15)8-9-19-16/h1-7,10,16,19H,8-9,11H2,(H,20,21)/p+1/t16-/m0/s1