3-[(1S,2R)-1,2-bis(azanyl)cyclohexyl]phthalate

Systemtic Name: 3-[(1S,2R)-1,2-bis(azanyl)cyclohexyl]phthalate Openeye Name: 3-[(1S,2R)-1,2-diaminocyclohexyl]phthalate CAS Name: 3-[(1S,2R)-1,2-diaminocyclohexyl]phthalate IUPAC Name: 3-[(1S,2R)-1,2-diaminocyclohexyl]phthalate Traditional Name: 3-[(1S,2R)-1,2-diaminocyclohexyl]phthalate Formula: C14H16N2O4-2 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)(C2=CC=CC(=C2C(=O)[O-])C(=O)[O-])N

Isomeric SMILES

C1CC[C@@]([C@@H](C1)N)(C2=CC=CC(=C2C(=O)[O-])C(=O)[O-])N

InChI

InChI=1S/C14H18N2O4/c15-10-6-1-2-7-14(10,16)9-5-3-4-8(12(17)18)11(9)13(19)20/h3-5,10H,1-2,6-7,15-16H2,(H,17,18)(H,19,20)/p-2/t10-,14+/m1/s1