methanesulfonic acid; N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine

Systemtic Name: methanesulfonic acid; N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine Openeye Name: methanesulfonic acid; N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine CAS Name: methanesulfonic acid; N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]-2-propanamine IUPAC Name: methanesulfonic acid; N-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]propan-2-amine Traditional Name: isopropyl-[(6-methyl-7-nitro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]amine; mesylic acid Formula: C15H25N3O5S MolecularWeight: 359.4411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCC(N2)CNC(C)C)[N+](=O)[O-].CS(=O)(=O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)CCC(N2)CNC(C)C)[N+](=O)[O-].CS(=O)(=O)O

InChI

InChI=1S/C14H21N3O2.CH4O3S/c1-9(2)15-8-12-5-4-11-6-10(3)14(17(18)19)7-13(11)16-12;1-5(2,3)4/h6-7,9,12,15-16H,4-5,8H2,1-3H3;1H3,(H,2,3,4)