4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)aniline

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)aniline Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)aniline CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)aniline IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)aniline Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylmethyl)phenyl]amine Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CC3=CC=C(C=C3)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CC3=CC=C(C=C3)N

InChI

InChI=1S/C16H18N2O2S/c17-16-7-5-13(6-8-16)12-21(19,20)18-10-9-14-3-1-2-4-15(14)11-18/h1-8H,9-12,17H2