[(1R,2R,4S)-2,4-bis(azanyl)cyclopentyl] 3-azanylbenzoate

Systemtic Name: [(1R,2R,4S)-2,4-bis(azanyl)cyclopentyl] 3-azanylbenzoate Openeye Name: [(1R,2R,4S)-2,4-diaminocyclopentyl] 3-aminobenzoate CAS Name: 3-aminobenzoic acid [(1R,2R,4S)-2,4-diaminocyclopentyl] ester IUPAC Name: [(1R,2R,4S)-2,4-diaminocyclopentyl] 3-aminobenzoate Traditional Name: 3-aminobenzoic acid [(1R,2R,4S)-2,4-diaminocyclopentyl] ester Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C1N)OC(=O)C2=CC(=CC=C2)N)N

Isomeric SMILES

C1[C@@H](C[C@H]([C@@H]1N)OC(=O)C2=CC(=CC=C2)N)N

InChI

InChI=1S/C12H17N3O2/c13-8-3-1-2-7(4-8)12(16)17-11-6-9(14)5-10(11)15/h1-4,9-11H,5-6,13-15H2/t9-,10+,11+/m0/s1