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

Systemtic Name: (3-cyclopentylcarbonyloxyphenyl) 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [3-(cyclopentanecarbonyloxy)phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [3-[cyclopentyl(oxo)methoxy]phenyl] ester IUPAC Name: [3-(cyclopentanecarbonyloxy)phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [3-(cyclopentanecarbonyloxy)phenyl] ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

Isomeric SMILES

C1CCC(C1)C(=O)OC2=CC=CC(=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

InChI

InChI=1S/C20H21N3O4/c21-20(22)23-15-10-8-14(9-11-15)19(25)27-17-7-3-6-16(12-17)26-18(24)13-4-1-2-5-13/h3,6-13H,1-2,4-5H2,(H4,21,22,23)