3-[bis(azanyl)methylideneamino]-4-(cyclopropylcarbonylamino)benzoic acid

Systemtic Name: 3-[bis(azanyl)methylideneamino]-4-(cyclopropylcarbonylamino)benzoic acid Openeye Name: 4-(cyclopropanecarbonylamino)-3-guanidino-benzoic acid CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]-3-(diaminomethylideneamino)benzoic acid IUPAC Name: 4-(cyclopropanecarbonylamino)-3-(diaminomethylideneamino)benzoic acid Traditional Name: 4-(cyclopropanecarbonylamino)-3-guanidino-benzoic acid Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=C(C=C(C=C2)C(=O)O)N=C(N)N

Isomeric SMILES

C1CC1C(=O)NC2=C(C=C(C=C2)C(=O)O)N=C(N)N

InChI

InChI=1S/C12H14N4O3/c13-12(14)16-9-5-7(11(18)19)3-4-8(9)15-10(17)6-1-2-6/h3-6H,1-2H2,(H,15,17)(H,18,19)(H4,13,14,16)