1-carbamimidoyl-1-ethyl-urea; 5-methoxy-2H-benzotriazole; hydrochloride

Systemtic Name: 1-carbamimidoyl-1-ethyl-urea; 5-methoxy-2H-benzotriazole; hydrochloride Openeye Name: 1-carbamimidoyl-1-ethyl-urea; 5-methoxy-2H-benzotriazole; hydrochloride CAS Name: 1-carbamimidoyl-1-ethylurea; 5-methoxy-2H-benzotriazole; hydrochloride IUPAC Name: 1-carbamimidoyl-1-ethylurea; 5-methoxy-2H-benzotriazole; hydrochloride Traditional Name: 1-amidino-1-ethyl-urea; 5-methoxy-2H-benzotriazole; hydrochloride Formula: C11H18ClN7O2 MolecularWeight: 315.75932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=N)N)C(=O)N.COC1=CC2=NNN=C2C=C1.Cl

Isomeric SMILES

CCN(C(=N)N)C(=O)N.COC1=CC2=NNN=C2C=C1.Cl

InChI

InChI=1S/C7H7N3O.C4H10N4O.ClH/c1-11-5-2-3-6-7(4-5)9-10-8-6;1-2-8(3(5)6)4(7)9;/h2-4H,1H3,(H,8,9,10);2H2,1H3,(H3,5,6)(H2,7,9);1H