(3-cyclohexylcarbonyloxyphenyl) 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: (3-cyclohexylcarbonyloxyphenyl) 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [3-(cyclohexanecarbonyloxy)phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [3-[cyclohexyl(oxo)methoxy]phenyl] ester IUPAC Name: [3-(cyclohexanecarbonyloxy)phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [3-(cyclohexanecarbonyloxy)phenyl] ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

Isomeric SMILES

C1CCC(CC1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

InChI

InChI=1S/C21H23N3O4/c22-21(23)24-16-11-9-15(10-12-16)20(26)28-18-8-4-7-17(13-18)27-19(25)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H4,22,23,24)