[3-(1-methylcyclopropyl)carbonyloxyphenyl] 4-[bis(azanyl)methylideneamino]-2-fluoranyl-benzoate

Systemtic Name: [3-(1-methylcyclopropyl)carbonyloxyphenyl] 4-[bis(azanyl)methylideneamino]-2-fluoranyl-benzoate Openeye Name: [3-(1-methylcyclopropanecarbonyl)oxyphenyl] 2-fluoro-4-guanidino-benzoate CAS Name: 4-(diaminomethylideneamino)-2-fluorobenzoic acid [3-[(1-methylcyclopropyl)-oxomethoxy]phenyl] ester IUPAC Name: [3-(1-methylcyclopropanecarbonyl)oxyphenyl] 4-(diaminomethylideneamino)-2-fluorobenzoate Traditional Name: 2-fluoro-4-guanidino-benzoic acid [3-(1-methylcyclopropanecarbonyl)oxyphenyl] ester Formula: C19H18FN3O4 MolecularWeight: 371.362323

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=C(C=C(C=C3)N=C(N)N)F

Isomeric SMILES

CC1(CC1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=C(C=C(C=C3)N=C(N)N)F

InChI

InChI=1S/C19H18FN3O4/c1-19(7-8-19)17(25)27-13-4-2-3-12(10-13)26-16(24)14-6-5-11(9-15(14)20)23-18(21)22/h2-6,9-10H,7-8H2,1H3,(H4,21,22,23)