4-chloranyl-N-methyl-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]aniline

Systemtic Name: 4-chloranyl-N-methyl-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]aniline Openeye Name: 4-chloro-N-methyl-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]aniline CAS Name: 4-chloro-N-methyl-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]aniline IUPAC Name: 4-chloro-N-methyl-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]aniline Traditional Name: [4-chloro-2-[(1S)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]phenyl]-methyl-amine Formula: C16H18ClN2+ MolecularWeight: 273.78052

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)Cl)C2C3=CC=CC=C3CC[NH2+]2

Isomeric SMILES

CNC1=C(C=C(C=C1)Cl)[C@@H]2C3=CC=CC=C3CC[NH2+]2

InChI

InChI=1S/C16H17ClN2/c1-18-15-7-6-12(17)10-14(15)16-13-5-3-2-4-11(13)8-9-19-16/h2-7,10,16,18-19H,8-9H2,1H3/p+1/t16-/m0/s1