4-phenylbutan-2-amine; sulfuric acid

Systemtic Name: 4-phenylbutan-2-amine; sulfuric acid Openeye Name: 4-phenylbutan-2-amine; sulfuric acid CAS Name: 4-phenyl-2-butanamine; sulfuric acid IUPAC Name: 4-phenylbutan-2-amine; sulfuric acid Traditional Name: (1-methyl-3-phenyl-propyl)amine; sulfuric acid Formula: C20H32N2O4S MolecularWeight: 396.54408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N.CC(CCC1=CC=CC=C1)N.OS(=O)(=O)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)N.CC(CCC1=CC=CC=C1)N.OS(=O)(=O)O

InChI

InChI=1S/2C10H15N.H2O4S/c2*1-9(11)7-8-10-5-3-2-4-6-10;1-5(2,3)4/h2*2-6,9H,7-8,11H2,1H3;(H2,1,2,3,4)