benzenesulfonic acid; 3-phenylpropane-1,2-diamine; platinum(2+)

Systemtic Name: benzenesulfonic acid; 3-phenylpropane-1,2-diamine; platinum(2+) Openeye Name: benzenesulfonic acid; 3-phenylpropane-1,2-diamine; platinum(2+) CAS Name: benzenesulfonic acid; 3-phenylpropane-1,2-diamine; platinum(2+) IUPAC Name: benzenesulfonic acid; 3-phenylpropane-1,2-diamine; platinum(2+) Traditional Name: [1-(aminomethyl)-2-phenyl-ethyl]amine; besylic acid; platinum(2+) Formula: C21H26N2O6PtS2+2 MolecularWeight: 661.64894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN)N.C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O.[Pt+2]

Isomeric SMILES

C1=CC=C(C=C1)CC(CN)N.C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O.[Pt+2]

InChI

InChI=1S/C9H14N2.2C6H6O3S.Pt/c10-7-9(11)6-8-4-2-1-3-5-8;2*7-10(8,9)6-4-2-1-3-5-6;/h1-5,9H,6-7,10-11H2;2*1-5H,(H,7,8,9);/q;;;+2