5,5,8a-trimethyl-2-prop-2-enyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 5,5,8a-trimethyl-2-prop-2-enyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-amine; 4-methylbenzenesulfonic acid Openeye Name: 2-allyl-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-amine; 4-methylbenzenesulfonic acid CAS Name: 5,5,8a-trimethyl-2-prop-2-enyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-amine; 4-methylbenzenesulfonic acid IUPAC Name: 5,5,8a-trimethyl-2-prop-2-enyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-amine; 4-methylbenzenesulfonic acid Traditional Name: (2-allyl-5,5,8a-trimethyl-3,6,7,8-tetrahydro-1H-isoquinolin-6-yl)amine; tosylic acid Formula: C22H34N2O3S MolecularWeight: 406.58196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(C(CCC2(C1=CCN(C2)CC=C)C)N)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(C(CCC2(C1=CCN(C2)CC=C)C)N)C

InChI

InChI=1S/C15H26N2.C7H8O3S/c1-5-9-17-10-7-12-14(2,3)13(16)6-8-15(12,4)11-17;1-6-2-4-7(5-3-6)11(8,9)10/h5,7,13H,1,6,8-11,16H2,2-4H3;2-5H,1H3,(H,8,9,10)