butane-2,3-dione; 1-phenylethane-1,2-diamine

Systemtic Name: butane-2,3-dione; 1-phenylethane-1,2-diamine Openeye Name: butane-2,3-dione; 1-phenylethane-1,2-diamine CAS Name: butane-2,3-dione; 1-phenylethane-1,2-diamine IUPAC Name: butane-2,3-dione; 1-phenylethane-1,2-diamine Traditional Name: (2-amino-1-phenyl-ethyl)amine; biacetyl Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)C.C1=CC=C(C=C1)C(CN)N

Isomeric SMILES

CC(=O)C(=O)C.C1=CC=C(C=C1)C(CN)N

InChI

InChI=1S/C8H12N2.C4H6O2/c9-6-8(10)7-4-2-1-3-5-7;1-3(5)4(2)6/h1-5,8H,6,9-10H2;1-2H3