2-acetyloxybenzoic acid; 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine

Systemtic Name: 2-acetyloxybenzoic acid; 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine Openeye Name: 2-acetoxybenzoic acid; 3-(diaminomethylene)-1,1-dimethyl-guanidine CAS Name: 2-acetyloxybenzoic acid; 3-(diaminomethylidene)-1,1-dimethylguanidine IUPAC Name: 2-acetyloxybenzoic acid; 3-(diaminomethylidene)-1,1-dimethylguanidine Traditional Name: 2-acetoxybenzoic acid; 3-(diaminomethylene)-1,1-dimethyl-guanidine Formula: C13H19N5O4 MolecularWeight: 309.32106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O.CN(C)C(=N)N=C(N)N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O.CN(C)C(=N)N=C(N)N

InChI

InChI=1S/C9H8O4.C4H11N5/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;1-9(2)4(7)8-3(5)6/h2-5H,1H3,(H,11,12);1-2H3,(H5,5,6,7,8)